| 3250 | | |
| 3251 | | > modelfix |
| 3252 | | |
| 3253 | | Changed 25299 atom styles |
| 3254 | | 23699 atoms, 24145 bonds, 9 pseudobonds, 2970 residues, 2 models selected |
| 3255 | | |
| 3256 | | > split #1 |
| 3257 | | |
| 3258 | | Split ylODC_54bpOriC061_rev29_PostPhenix.pdb (#1) into 9 models |
| 3259 | | Chain information for ylODC_54bpOriC061_rev29_PostPhenix.pdb A #1.1 |
| 3260 | | --- |
| 3261 | | Chain | Description |
| 3262 | | A | No description available |
| 3263 | | |
| 3264 | | Chain information for ylODC_54bpOriC061_rev29_PostPhenix.pdb B #1.2 |
| 3265 | | --- |
| 3266 | | Chain | Description |
| 3267 | | B | No description available |
| 3268 | | |
| 3269 | | Chain information for ylODC_54bpOriC061_rev29_PostPhenix.pdb C #1.3 |
| 3270 | | --- |
| 3271 | | Chain | Description |
| 3272 | | C | No description available |
| 3273 | | |
| 3274 | | Chain information for ylODC_54bpOriC061_rev29_PostPhenix.pdb D #1.4 |
| 3275 | | --- |
| 3276 | | Chain | Description |
| 3277 | | D | No description available |
| 3278 | | |
| 3279 | | Chain information for ylODC_54bpOriC061_rev29_PostPhenix.pdb E #1.5 |
| 3280 | | --- |
| 3281 | | Chain | Description |
| 3282 | | E | No description available |
| 3283 | | |
| 3284 | | Chain information for ylODC_54bpOriC061_rev29_PostPhenix.pdb F #1.6 |
| 3285 | | --- |
| 3286 | | Chain | Description |
| 3287 | | F | No description available |
| 3288 | | |
| 3289 | | Chain information for ylODC_54bpOriC061_rev29_PostPhenix.pdb G #1.7 |
| 3290 | | --- |
| 3291 | | Chain | Description |
| 3292 | | G | No description available |
| 3293 | | |
| 3294 | | Chain information for ylODC_54bpOriC061_rev29_PostPhenix.pdb H #1.8 |
| 3295 | | --- |
| 3296 | | Chain | Description |
| 3297 | | H | No description available |
| 3298 | | |
| 3299 | | Chain information for ylODC_54bpOriC061_rev29_PostPhenix.pdb I #1.9 |
| 3300 | | --- |
| 3301 | | Chain | Description |
| 3302 | | I | No description available |
| 3303 | | |
| 3304 | | |
| 3305 | | > hide #!1.1 models |
| 3306 | | |
| 3307 | | > hide #1.2 models |
| 3308 | | |
| 3309 | | > hide #!1.3 models |
| 3310 | | |
| 3311 | | > hide #!1.5 models |
| 3312 | | |
| 3313 | | > show #!1.5 models |
| 3314 | | |
| 3315 | | > hide #!1.6 models |
| 3316 | | |
| 3317 | | > select /G:548 |
| 3318 | | |
| 3319 | | 9 atoms, 8 bonds, 1 residue, 1 model selected |
| 3320 | | |
| 3321 | | > show sel atoms |
| 3322 | | |
| 3323 | | Unsupported scale factor (0.000000) detected on Display0 |
| 3324 | | |
| 3325 | | Unsupported scale factor (0.000000) detected on Display1 |
| 3326 | | |
| 3327 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 3328 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 3329 | | > structures/Projects-maps/ylODC_54bp- |
| 3330 | | > oriC061_complete/cryosparc_P370_J327_even_better_Orc2WHD.mrc" |
| 3331 | | |
| 3332 | | Opened cryosparc_P370_J327_even_better_Orc2WHD.mrc as #2, grid size |
| 3333 | | 440,440,440, pixel 0.827, shown at level 0.0402, step 2, values float32 |
| 3334 | | |
| 3335 | | > volume #2 step 1 |
| 3336 | | |
| 3337 | | > volume #2 level 0.1468 |
| 3338 | | |
| 3339 | | > select clear |
| 3340 | | |
| 3341 | | > ui mousemode right translate |
| 3342 | | |
| 3343 | | > ui mousemode right zoom |
| 3344 | | |
| 3345 | | > ui mousemode right translate |
| 3346 | | |
| 3347 | | > vop flip #2 |
| 3348 | | |
| 3349 | | Opened cryosparc_P370_J327_even_better_Orc2WHD.mrc z flip as #3, grid size |
| 3350 | | 440,440,440, pixel 0.827, shown at step 1, values float32 |
| 3351 | | |
| 3352 | | > save "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 3353 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 3354 | | > structures/Projects-maps/ylODC_54bp- |
| 3355 | | > oriC061_complete/cryosparc_P370_J327_FLIPPED_even_better_Orc2WHD.mrc" models |
| 3356 | | > #3 |
| 3357 | | |
| 3358 | | Unsupported scale factor (0.000000) detected on Display1 |
| 3359 | | |
| 3360 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 3361 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 3362 | | > structures/Projects-maps/ylODC_54bp- |
| 3363 | | > oriC061_complete/cryosparc_P370_J418_local_refine_even_better_Orc2WHD.mrc" |
| 3364 | | |
| 3365 | | Opened cryosparc_P370_J418_local_refine_even_better_Orc2WHD.mrc as #4, grid |
| 3366 | | size 440,440,440, pixel 0.827, shown at level 0.0436, step 2, values float32 |
| 3367 | | |
| 3368 | | > select ~sel & ##selected |
| 3369 | | |
| 3370 | | Nothing selected |
| 3371 | | |
| 3372 | | > vop flip #4 |
| 3373 | | |
| 3374 | | Opened cryosparc_P370_J418_local_refine_even_better_Orc2WHD.mrc z flip as #5, |
| 3375 | | grid size 440,440,440, pixel 0.827, shown at step 1, values float32 |
| 3376 | | |
| 3377 | | > close #4 |
| 3378 | | |
| 3379 | | > volume #5 level 0.1372 |
| 3380 | | |
| 3381 | | > volume #3 level 0.14 |
| 3382 | | |
| 3383 | | > volume #5 level 0.14 |
| 3384 | | |
| 3385 | | > volume #5 level 0.1 |
| 3386 | | |
| 3387 | | > volume #3 level 0.1 |
| 3388 | | |
| 3389 | | > volume #3 level 0.0813 |
| 3390 | | |
| 3391 | | > volume #3 level 0.1 |
| 3392 | | |
| 3393 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 3394 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 3395 | | > structures/Projects-maps/ylODC_54bp- |
| 3396 | | > oriC061_complete/cryosparc_P370_J420_even_better_Orc2WHD-sharp.mrc" |
| 3397 | | |
| 3398 | | Opened cryosparc_P370_J420_even_better_Orc2WHD-sharp.mrc as #4, grid size |
| 3399 | | 440,440,440, pixel 0.827, shown at level 0.0683, step 2, values float32 |
| 3400 | | |
| 3401 | | > close #5 |
| 3402 | | |
| 3403 | | > vop flip #4 |
| 3404 | | |
| 3405 | | Opened cryosparc_P370_J420_even_better_Orc2WHD-sharp.mrc z flip as #5, grid |
| 3406 | | size 440,440,440, pixel 0.827, shown at step 1, values float32 |
| 3407 | | |
| 3408 | | > close #4 |
| 3409 | | |
| 3410 | | > volume #5 level 0.1 |
| 3411 | | |
| 3412 | | > volume #5 level 0.12 |
| 3413 | | |
| 3414 | | > volume #5 level 0.1 |
| 3415 | | |
| 3416 | | > volume #5 level 0.095 |
| 3417 | | |
| 3418 | | > volume #5 level 0.08 |
| 3419 | | |
| 3420 | | > hide #!3 models |
| 3421 | | |
| 3422 | | > hide #!1 models |
| 3423 | | |
| 3424 | | > surface dust #5 size 8.27 |
| 3425 | | |
| 3426 | | > close #5 |
| 3427 | | |
| 3428 | | > open /Users/jtbauer/Library/CloudStorage/OneDrive- |
| 3429 | | > Personal/Documents/ROTATION_WORK/Joshua- |
| 3430 | | > Tor_Lab/test_a3d8f/test_a3d8f_relaxed_rank_001_alphafold2_multimer_v3_model_5_seed_000.pdb |
| 3431 | | |
| 3432 | | Chain information for |
| 3433 | | test_a3d8f_relaxed_rank_001_alphafold2_multimer_v3_model_5_seed_000.pdb #4 |
| 3434 | | --- |
| 3435 | | Chain | Description |
| 3436 | | A | No description available |
| 3437 | | B | No description available |
| 3438 | | |
| 3439 | | Computing secondary structure |
| 3440 | | |
| 3441 | | > select add #4 |
| 3442 | | |
| 3443 | | 6005 atoms, 6077 bonds, 374 residues, 1 model selected |
| 3444 | | |
| 3445 | | > ui mousemode right select |
| 3446 | | |
| 3447 | | > select clear |
| 3448 | | |
| 3449 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 3450 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/test_a3d8f/1j7v-crystal |
| 3451 | | > structure.pdb" |
| 3452 | | |
| 3453 | | 1j7v-crystal structure.pdb title: |
| 3454 | | Human il-10 / il-10R1 complex [more info...] |
| 3455 | | |
| 3456 | | Chain information for 1j7v-crystal structure.pdb #5 |
| 3457 | | --- |
| 3458 | | Chain | Description | UniProt |
| 3459 | | L | IL-10; cytokine synthesis inhibitory factor; CSIF | IL10_HUMAN 1-160 |
| 3460 | | R | IL-10R1; IL-10R-A | I10R1_HUMAN 1-214 |
| 3461 | | |
| 3462 | | 13 atoms have alternate locations. Control/examine alternate locations with |
| 3463 | | Altloc Explorer [start tool...] or the altlocs command. |
| 3464 | | |
| 3465 | | > matchmaker #4 to #5 |
| 3466 | | |
| 3467 | | Computing secondary structure |
| 3468 | | Parameters |
| 3469 | | --- |
| 3470 | | Chain pairing | bb |
| 3471 | | Alignment algorithm | Needleman-Wunsch |
| 3472 | | Similarity matrix | BLOSUM-62 |
| 3473 | | SS fraction | 0.3 |
| 3474 | | Gap open (HH/SS/other) | 18/18/6 |
| 3475 | | Gap extend | 1 |
| 3476 | | SS matrix | | | H | S | O |
| 3477 | | ---|---|---|--- |
| 3478 | | H | 6 | -9 | -6 |
| 3479 | | S | | 6 | -6 |
| 3480 | | O | | | 4 |
| 3481 | | Iteration cutoff | 2 |
| 3482 | | |
| 3483 | | Matchmaker 1j7v-crystal structure.pdb, chain R (#5) with |
| 3484 | | test_a3d8f_relaxed_rank_001_alphafold2_multimer_v3_model_5_seed_000.pdb, chain |
| 3485 | | B (#4), sequence alignment score = 1073 |
| 3486 | | RMSD between 192 pruned atom pairs is 0.747 angstroms; (across all 205 pairs: |
| 3487 | | 1.150) |
| 3488 | | |
| 3489 | | |
| 3490 | | > open /Users/jtbauer/Library/CloudStorage/OneDrive- |
| 3491 | | > Personal/Documents/ROTATION_WORK/Joshua- |
| 3492 | | > Tor_Lab/test_a3d8f/test_a3d8f_relaxed_rank_002_alphafold2_multimer_v3_model_4_seed_000.pdb |
| 3493 | | |
| 3494 | | Chain information for |
| 3495 | | test_a3d8f_relaxed_rank_002_alphafold2_multimer_v3_model_4_seed_000.pdb #6 |
| 3496 | | --- |
| 3497 | | Chain | Description |
| 3498 | | A | No description available |
| 3499 | | B | No description available |
| 3500 | | |
| 3501 | | Computing secondary structure |
| 3502 | | |
| 3503 | | > select ~sel & ##selected |
| 3504 | | |
| 3505 | | Nothing selected |
| 3506 | | |
| 3507 | | > matchmaker #6 to #5 |
| 3508 | | |
| 3509 | | Computing secondary structure |
| 3510 | | Parameters |
| 3511 | | --- |
| 3512 | | Chain pairing | bb |
| 3513 | | Alignment algorithm | Needleman-Wunsch |
| 3514 | | Similarity matrix | BLOSUM-62 |
| 3515 | | SS fraction | 0.3 |
| 3516 | | Gap open (HH/SS/other) | 18/18/6 |
| 3517 | | Gap extend | 1 |
| 3518 | | SS matrix | | | H | S | O |
| 3519 | | ---|---|---|--- |
| 3520 | | H | 6 | -9 | -6 |
| 3521 | | S | | 6 | -6 |
| 3522 | | O | | | 4 |
| 3523 | | Iteration cutoff | 2 |
| 3524 | | |
| 3525 | | Matchmaker 1j7v-crystal structure.pdb, chain R (#5) with |
| 3526 | | test_a3d8f_relaxed_rank_002_alphafold2_multimer_v3_model_4_seed_000.pdb, chain |
| 3527 | | B (#6), sequence alignment score = 1073 |
| 3528 | | RMSD between 191 pruned atom pairs is 0.713 angstroms; (across all 205 pairs: |
| 3529 | | 1.091) |
| 3530 | | |
| 3531 | | |
| 3532 | | > close #4 |
| 3533 | | |
| 3534 | | > close #6 |
| 3535 | | |
| 3536 | | > ui tool show "Unit Cell" |
| 3537 | | |
| 3538 | | > unitcell #5 |
| 3539 | | |
| 3540 | | > unitcell delete #5 |
| 3541 | | |
| 3542 | | > unitcell #5 |
| 3543 | | |
| 3544 | | Drag select of 587 residues |
| 3545 | | |
| 3546 | | > delete sel |
| 3547 | | |
| 3548 | | Drag select of 832 residues, 8 pseudobonds |
| 3549 | | |
| 3550 | | > delete sel |
| 3551 | | |
| 3552 | | > open /Users/jtbauer/Library/CloudStorage/OneDrive- |
| 3553 | | > Personal/Documents/ROTATION_WORK/Joshua- |
| 3554 | | > Tor_Lab/test_a3d8f/test_566b6.result.zip |
| 3555 | | |
| 3556 | | Unrecognized file suffix '.zip' |
| 3557 | | |
| 3558 | | > open /Users/jtbauer/Library/CloudStorage/OneDrive- |
| 3559 | | > Personal/Documents/ROTATION_WORK/Joshua- |
| 3560 | | > Tor_Lab/test_a3d8f/test_566b6/test_566b6_relaxed_rank_001_alphafold2_multimer_v3_model_3_seed_000.pdb |
| 3561 | | |
| 3562 | | Chain information for |
| 3563 | | test_566b6_relaxed_rank_001_alphafold2_multimer_v3_model_3_seed_000.pdb #6 |
| 3564 | | --- |
| 3565 | | Chain | Description |
| 3566 | | A B | No description available |
| 3567 | | C D | No description available |
| 3568 | | |
| 3569 | | Computing secondary structure |
| 3570 | | |
| 3571 | | > hide #!4 models |
| 3572 | | |
| 3573 | | > show #!4 models |
| 3574 | | |
| 3575 | | > hide #5 models |
| 3576 | | |
| 3577 | | > show #5 models |
| 3578 | | |
| 3579 | | > hide #5 models |
| 3580 | | |
| 3581 | | > hide #!4 models |
| 3582 | | |
| 3583 | | > show #5 models |
| 3584 | | |
| 3585 | | > hide #5 models |
| 3586 | | |
| 3587 | | > show #!4 models |
| 3588 | | |
| 3589 | | > hide #!4 models |
| 3590 | | |
| 3591 | | > show #5 models |
| 3592 | | |
| 3593 | | > hide #5 models |
| 3594 | | |
| 3595 | | > show #!4 models |
| 3596 | | |
| 3597 | | > close #5 |
| 3598 | | |
| 3599 | | > matchmaker #6 to #4 |
| 3600 | | |
| 3601 | | Specify a single 'to' model only |
| 3602 | | |
| 3603 | | > hide #4.1 models |
| 3604 | | |
| 3605 | | > show #4.1 models |
| 3606 | | |
| 3607 | | > hide #4.2 models |
| 3608 | | |
| 3609 | | > show #4.2 models |
| 3610 | | |
| 3611 | | > hide #!4.3 models |
| 3612 | | |
| 3613 | | > show #!4.3 models |
| 3614 | | |
| 3615 | | > hide #4.4 models |
| 3616 | | |
| 3617 | | > show #4.4 models |
| 3618 | | |
| 3619 | | > close #4 |
| 3620 | | |
| 3621 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 3622 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/test_a3d8f/1j7v-crystal |
| 3623 | | > structure.pdb" format pdb |
| 3624 | | |
| 3625 | | 1j7v-crystal structure.pdb title: |
| 3626 | | Human il-10 / il-10R1 complex [more info...] |
| 3627 | | |
| 3628 | | Chain information for 1j7v-crystal structure.pdb #4 |
| 3629 | | --- |
| 3630 | | Chain | Description | UniProt |
| 3631 | | L | IL-10; cytokine synthesis inhibitory factor; CSIF | IL10_HUMAN 1-160 |
| 3632 | | R | IL-10R1; IL-10R-A | I10R1_HUMAN 1-214 |
| 3633 | | |
| 3634 | | 13 atoms have alternate locations. Control/examine alternate locations with |
| 3635 | | Altloc Explorer [start tool...] or the altlocs command. |
| 3636 | | |
| 3637 | | > unitcell #4 |
| 3638 | | |
| 3639 | | > combine #5 |
| 3640 | | |
| 3641 | | Remapping chain ID 'L' in 1j7v-crystal structure.pdb #2 #5.2 to 'M' |
| 3642 | | Remapping chain ID 'R' in 1j7v-crystal structure.pdb #2 #5.2 to 'S' |
| 3643 | | Remapping chain ID 'L' in 1j7v-crystal structure.pdb #3 #5.3 to 'N' |
| 3644 | | Remapping chain ID 'R' in 1j7v-crystal structure.pdb #3 #5.3 to 'T' |
| 3645 | | Remapping chain ID 'L' in 1j7v-crystal structure.pdb #4 #5.4 to 'O' |
| 3646 | | Remapping chain ID 'R' in 1j7v-crystal structure.pdb #4 #5.4 to 'U' |
| 3647 | | Remapping chain ID 'L' in 1j7v-crystal structure.pdb #5 #5.5 to 'P' |
| 3648 | | Remapping chain ID 'R' in 1j7v-crystal structure.pdb #5 #5.5 to 'V' |
| 3649 | | Remapping chain ID 'L' in 1j7v-crystal structure.pdb #6 #5.6 to 'Q' |
| 3650 | | Remapping chain ID 'R' in 1j7v-crystal structure.pdb #6 #5.6 to 'W' |
| 3651 | | |
| 3652 | | > hide #4 models |
| 3653 | | |
| 3654 | | > hide #!5 models |
| 3655 | | |
| 3656 | | > matchmaker #6 to #7 |
| 3657 | | |
| 3658 | | Computing secondary structure |
| 3659 | | Parameters |
| 3660 | | --- |
| 3661 | | Chain pairing | bb |
| 3662 | | Alignment algorithm | Needleman-Wunsch |
| 3663 | | Similarity matrix | BLOSUM-62 |
| 3664 | | SS fraction | 0.3 |
| 3665 | | Gap open (HH/SS/other) | 18/18/6 |
| 3666 | | Gap extend | 1 |
| 3667 | | SS matrix | | | H | S | O |
| 3668 | | ---|---|---|--- |
| 3669 | | H | 6 | -9 | -6 |
| 3670 | | S | | 6 | -6 |
| 3671 | | O | | | 4 |
| 3672 | | Iteration cutoff | 2 |
| 3673 | | |
| 3674 | | Matchmaker combination, chain R (#7) with |
| 3675 | | test_566b6_relaxed_rank_001_alphafold2_multimer_v3_model_3_seed_000.pdb, chain |
| 3676 | | C (#6), sequence alignment score = 1073 |
| 3677 | | RMSD between 194 pruned atom pairs is 0.648 angstroms; (across all 205 pairs: |
| 3678 | | 1.044) |
| 3679 | | |
| 3680 | | |
| 3681 | | > select add #6 |
| 3682 | | |
| 3683 | | 12010 atoms, 12154 bonds, 748 residues, 1 model selected |
| 3684 | | |
| 3685 | | > ui mousemode right "translate selected models" |
| 3686 | | |
| 3687 | | > view matrix models |
| 3688 | | > #6,0.51645,0.16079,-0.84109,16.615,-0.7222,0.60956,-0.32692,27.053,0.46012,0.77627,0.43093,122.67 |
| 3689 | | |
| 3690 | | > matchmaker #6 to #7 |
| 3691 | | |
| 3692 | | Computing secondary structure |
| 3693 | | Parameters |
| 3694 | | --- |
| 3695 | | Chain pairing | bb |
| 3696 | | Alignment algorithm | Needleman-Wunsch |
| 3697 | | Similarity matrix | BLOSUM-62 |
| 3698 | | SS fraction | 0.3 |
| 3699 | | Gap open (HH/SS/other) | 18/18/6 |
| 3700 | | Gap extend | 1 |
| 3701 | | SS matrix | | | H | S | O |
| 3702 | | ---|---|---|--- |
| 3703 | | H | 6 | -9 | -6 |
| 3704 | | S | | 6 | -6 |
| 3705 | | O | | | 4 |
| 3706 | | Iteration cutoff | 2 |
| 3707 | | |
| 3708 | | Matchmaker combination, chain R (#7) with |
| 3709 | | test_566b6_relaxed_rank_001_alphafold2_multimer_v3_model_3_seed_000.pdb, chain |
| 3710 | | C (#6), sequence alignment score = 1073 |
| 3711 | | RMSD between 194 pruned atom pairs is 0.648 angstroms; (across all 205 pairs: |
| 3712 | | 1.044) |
| 3713 | | |
| 3714 | | |
| 3715 | | > view matrix models |
| 3716 | | > #6,0.51645,0.16079,-0.84109,16.006,-0.7222,0.60956,-0.32692,15.467,0.46012,0.77627,0.43093,137.76 |
| 3717 | | |
| 3718 | | > view matrix models |
| 3719 | | > #6,0.51645,0.16079,-0.84109,12.455,-0.7222,0.60956,-0.32692,-15.933,0.46012,0.77627,0.43093,154.19 |
| 3720 | | |
| 3721 | | > view matrix models |
| 3722 | | > #6,0.51645,0.16079,-0.84109,7.4024,-0.7222,0.60956,-0.32692,10.581,0.46012,0.77627,0.43093,164.48 |
| 3723 | | |
| 3724 | | > view matrix models |
| 3725 | | > #6,0.51645,0.16079,-0.84109,77.402,-0.7222,0.60956,-0.32692,32.484,0.46012,0.77627,0.43093,91.425 |
| 3726 | | |
| 3727 | | > close #6 |
| 3728 | | |
| 3729 | | > open /Users/jtbauer/Library/CloudStorage/OneDrive- |
| 3730 | | > Personal/Documents/ROTATION_WORK/Joshua- |
| 3731 | | > Tor_Lab/test_a3d8f/test_566b6/test_566b6_relaxed_rank_002_alphafold2_multimer_v3_model_1_seed_000.pdb |
| 3732 | | |
| 3733 | | Chain information for |
| 3734 | | test_566b6_relaxed_rank_002_alphafold2_multimer_v3_model_1_seed_000.pdb #6 |
| 3735 | | --- |
| 3736 | | Chain | Description |
| 3737 | | A B | No description available |
| 3738 | | C D | No description available |
| 3739 | | |
| 3740 | | Computing secondary structure |
| 3741 | | |
| 3742 | | > matchmaker #6 to #7 |
| 3743 | | |
| 3744 | | Computing secondary structure |
| 3745 | | Parameters |
| 3746 | | --- |
| 3747 | | Chain pairing | bb |
| 3748 | | Alignment algorithm | Needleman-Wunsch |
| 3749 | | Similarity matrix | BLOSUM-62 |
| 3750 | | SS fraction | 0.3 |
| 3751 | | Gap open (HH/SS/other) | 18/18/6 |
| 3752 | | Gap extend | 1 |
| 3753 | | SS matrix | | | H | S | O |
| 3754 | | ---|---|---|--- |
| 3755 | | H | 6 | -9 | -6 |
| 3756 | | S | | 6 | -6 |
| 3757 | | O | | | 4 |
| 3758 | | Iteration cutoff | 2 |
| 3759 | | |
| 3760 | | Matchmaker combination, chain R (#7) with |
| 3761 | | test_566b6_relaxed_rank_002_alphafold2_multimer_v3_model_1_seed_000.pdb, chain |
| 3762 | | C (#6), sequence alignment score = 1052 |
| 3763 | | RMSD between 190 pruned atom pairs is 0.752 angstroms; (across all 205 pairs: |
| 3764 | | 1.415) |
| 3765 | | |
| 3766 | | |
| 3767 | | > close #6 |
| 3768 | | |
| 3769 | | > open /Users/jtbauer/Library/CloudStorage/OneDrive- |
| 3770 | | > Personal/Documents/ROTATION_WORK/Joshua- |
| 3771 | | > Tor_Lab/test_a3d8f/test_566b6/test_566b6_relaxed_rank_003_alphafold2_multimer_v3_model_2_seed_000.pdb |
| 3772 | | |
| 3773 | | Chain information for |
| 3774 | | test_566b6_relaxed_rank_003_alphafold2_multimer_v3_model_2_seed_000.pdb #6 |
| 3775 | | --- |
| 3776 | | Chain | Description |
| 3777 | | A B | No description available |
| 3778 | | C D | No description available |
| 3779 | | |
| 3780 | | Computing secondary structure |
| 3781 | | |
| 3782 | | > matchmaker #6 to #7 |
| 3783 | | |
| 3784 | | Computing secondary structure |
| 3785 | | Parameters |
| 3786 | | --- |
| 3787 | | Chain pairing | bb |
| 3788 | | Alignment algorithm | Needleman-Wunsch |
| 3789 | | Similarity matrix | BLOSUM-62 |
| 3790 | | SS fraction | 0.3 |
| 3791 | | Gap open (HH/SS/other) | 18/18/6 |
| 3792 | | Gap extend | 1 |
| 3793 | | SS matrix | | | H | S | O |
| 3794 | | ---|---|---|--- |
| 3795 | | H | 6 | -9 | -6 |
| 3796 | | S | | 6 | -6 |
| 3797 | | O | | | 4 |
| 3798 | | Iteration cutoff | 2 |
| 3799 | | |
| 3800 | | Matchmaker combination, chain R (#7) with |
| 3801 | | test_566b6_relaxed_rank_003_alphafold2_multimer_v3_model_2_seed_000.pdb, chain |
| 3802 | | D (#6), sequence alignment score = 1073 |
| 3803 | | RMSD between 196 pruned atom pairs is 0.731 angstroms; (across all 205 pairs: |
| 3804 | | 1.005) |
| 3805 | | |
| 3806 | | |
| 3807 | | > close #6 |
| 3808 | | |
| 3809 | | > open /Users/jtbauer/Library/CloudStorage/OneDrive- |
| 3810 | | > Personal/Documents/ROTATION_WORK/Joshua- |
| 3811 | | > Tor_Lab/test_a3d8f/test_566b6/test_566b6_relaxed_rank_004_alphafold2_multimer_v3_model_4_seed_000.pdb |
| 3812 | | |
| 3813 | | Chain information for |
| 3814 | | test_566b6_relaxed_rank_004_alphafold2_multimer_v3_model_4_seed_000.pdb #6 |
| 3815 | | --- |
| 3816 | | Chain | Description |
| 3817 | | A B | No description available |
| 3818 | | C D | No description available |
| 3819 | | |
| 3820 | | Computing secondary structure |
| 3821 | | |
| 3822 | | > matchmaker #6 to #7 |
| 3823 | | |
| 3824 | | Computing secondary structure |
| 3825 | | Parameters |
| 3826 | | --- |
| 3827 | | Chain pairing | bb |
| 3828 | | Alignment algorithm | Needleman-Wunsch |
| 3829 | | Similarity matrix | BLOSUM-62 |
| 3830 | | SS fraction | 0.3 |
| 3831 | | Gap open (HH/SS/other) | 18/18/6 |
| 3832 | | Gap extend | 1 |
| 3833 | | SS matrix | | | H | S | O |
| 3834 | | ---|---|---|--- |
| 3835 | | H | 6 | -9 | -6 |
| 3836 | | S | | 6 | -6 |
| 3837 | | O | | | 4 |
| 3838 | | Iteration cutoff | 2 |
| 3839 | | |
| 3840 | | Matchmaker combination, chain R (#7) with |
| 3841 | | test_566b6_relaxed_rank_004_alphafold2_multimer_v3_model_4_seed_000.pdb, chain |
| 3842 | | C (#6), sequence alignment score = 1073 |
| 3843 | | RMSD between 193 pruned atom pairs is 0.707 angstroms; (across all 205 pairs: |
| 3844 | | 1.082) |
| 3845 | | |
| 3846 | | |
| 3847 | | > close #6 |
| 3848 | | |
| 3849 | | > open /Users/jtbauer/Library/CloudStorage/OneDrive- |
| 3850 | | > Personal/Documents/ROTATION_WORK/Joshua- |
| 3851 | | > Tor_Lab/test_a3d8f/test_566b6/test_566b6_relaxed_rank_005_alphafold2_multimer_v3_model_5_seed_000.pdb |
| 3852 | | |
| 3853 | | Chain information for |
| 3854 | | test_566b6_relaxed_rank_005_alphafold2_multimer_v3_model_5_seed_000.pdb #6 |
| 3855 | | --- |
| 3856 | | Chain | Description |
| 3857 | | A B | No description available |
| 3858 | | C D | No description available |
| 3859 | | |
| 3860 | | Computing secondary structure |
| 3861 | | |
| 3862 | | > matchmaker #6 to #7 |
| 3863 | | |
| 3864 | | Computing secondary structure |
| 3865 | | Parameters |
| 3866 | | --- |
| 3867 | | Chain pairing | bb |
| 3868 | | Alignment algorithm | Needleman-Wunsch |
| 3869 | | Similarity matrix | BLOSUM-62 |
| 3870 | | SS fraction | 0.3 |
| 3871 | | Gap open (HH/SS/other) | 18/18/6 |
| 3872 | | Gap extend | 1 |
| 3873 | | SS matrix | | | H | S | O |
| 3874 | | ---|---|---|--- |
| 3875 | | H | 6 | -9 | -6 |
| 3876 | | S | | 6 | -6 |
| 3877 | | O | | | 4 |
| 3878 | | Iteration cutoff | 2 |
| 3879 | | |
| 3880 | | Matchmaker combination, chain R (#7) with |
| 3881 | | test_566b6_relaxed_rank_005_alphafold2_multimer_v3_model_5_seed_000.pdb, chain |
| 3882 | | C (#6), sequence alignment score = 1073 |
| 3883 | | RMSD between 192 pruned atom pairs is 0.722 angstroms; (across all 205 pairs: |
| 3884 | | 1.163) |
| 3885 | | |
| 3886 | | |
| 3887 | | > close #6 |
| 3888 | | |
| 3889 | | > close #7 |
| 3890 | | |
| 3891 | | > close #5 |
| 3892 | | |
| 3893 | | > close #4 |
| 3894 | | |
| 3895 | | > close #1 |
| 3896 | | |
| 3897 | | > close |
| 3898 | | |
| 3899 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 3900 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 3901 | | > structures/PDBs/ylODC_54bp- |
| 3902 | | > oriC061_complete/ylODC_54bpOriC061_rev29_PostPhenix.pdb" |
| 3903 | | |
| 3904 | | Chain information for ylODC_54bpOriC061_rev29_PostPhenix.pdb #1 |
| 3905 | | --- |
| 3906 | | Chain | Description |
| 3907 | | A | No description available |
| 3908 | | B | No description available |
| 3909 | | C | No description available |
| 3910 | | D | No description available |
| 3911 | | E | No description available |
| 3912 | | F | No description available |
| 3913 | | G | No description available |
| 3914 | | H | No description available |
| 3915 | | I | No description available |
| 3916 | | |
| 3917 | | |
| 3918 | | > modelfix |
| 3919 | | |
| 3920 | | Changed 25299 atom styles |
| 3921 | | 23699 atoms, 24145 bonds, 9 pseudobonds, 2970 residues, 2 models selected |
| 3922 | | |
| 3923 | | > hide #!1 models |
| 3924 | | |
| 3925 | | > open /Users/jtbauer/Library/CloudStorage/OneDrive- |
| 3926 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/7jk3-dmODC_GCrich.pdb |
| 3927 | | |
| 3928 | | 7jk3-dmODC_GCrich.pdb title: |
| 3929 | | Structure of drosophila orc bound to GC-rich DNA and CDC6 [more info...] |
| 3930 | | |
| 3931 | | Chain information for 7jk3-dmODC_GCrich.pdb #2 |
| 3932 | | --- |
| 3933 | | Chain | Description | UniProt |
| 3934 | | A | DMORC1 | ORC1_DROME 440-924 |
| 3935 | | B | DMORC2 | ORC2_DROME 1-618 |
| 3936 | | C | origin recognition complex subunit 3 | Q7K2L1_DROME 1-721 |
| 3937 | | D | ORC4 | Q9W102_DROME 1-459 |
| 3938 | | E | ORC5 | ORC5_DROME 1-460 |
| 3939 | | F | ORC6 | ORC6_DROME 1-257 |
| 3940 | | G | CDC6 | Q9VSM9_DROME 242-662 |
| 3941 | | H | DNA (33-mer) | |
| 3942 | | I | DNA (33-mer) | |
| 3943 | | |
| 3944 | | Non-standard residues in 7jk3-dmODC_GCrich.pdb #2 |
| 3945 | | --- |
| 3946 | | ATP — adenosine-5'-triphosphate |
| 3947 | | MG — magnesium ion |
| 3948 | | |
| 3949 | | |
| 3950 | | > close #2 |
| 3951 | | |
| 3952 | | > open /Users/jtbauer/Library/CloudStorage/OneDrive- |
| 3953 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/hsORC1-6_CDC6_60bpDNA.pdb |
| 3954 | | |
| 3955 | | Chain information for hsORC1-6_CDC6_60bpDNA.pdb #2 |
| 3956 | | --- |
| 3957 | | Chain | Description |
| 3958 | | A | No description available |
| 3959 | | B | No description available |
| 3960 | | C | No description available |
| 3961 | | D | No description available |
| 3962 | | E | No description available |
| 3963 | | F | No description available |
| 3964 | | G | No description available |
| 3965 | | H | No description available |
| 3966 | | I | No description available |
| 3967 | | |
| 3968 | | |
| 3969 | | > modelfix |
| 3970 | | |
| 3971 | | Changed 46715 atom styles |
| 3972 | | 43798 atoms, 44629 bonds, 22 pseudobonds, 5455 residues, 4 models selected |
| 3973 | | Computing secondary structure |
| 3974 | | |
| 3975 | | > open /Users/jtbauer/Library/CloudStorage/OneDrive- |
| 3976 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/7mca-assembly1.cif |
| 3977 | | |
| 3978 | | 7mca-assembly1.cif title: |
| 3979 | | Structure of the S. cerevisiae origin recognition complex bound to the |
| 3980 | | replication initiator Cdc6 and the ARS1 origin DNA. [more info...] |
| 3981 | | |
| 3982 | | Chain information for 7mca-assembly1.cif #3 |
| 3983 | | --- |
| 3984 | | Chain | Description |
| 3985 | | A | Origin recognition complex subunit 1 |
| 3986 | | B | Origin recognition complex subunit 2 |
| 3987 | | C | Origin recognition complex subunit 3 |
| 3988 | | D | Origin recognition complex subunit 4 |
| 3989 | | E | Origin recognition complex subunit 5 |
| 3990 | | F | Origin recognition complex subunit 6 |
| 3991 | | G | DNA (85-MER) |
| 3992 | | H | DNA (85-MER) |
| 3993 | | I | Cell division control protein 6 |
| 3994 | | |
| 3995 | | Non-standard residues in 7mca-assembly1.cif #3 |
| 3996 | | --- |
| 3997 | | AGS — phosphothiophosphoric acid-adenylate ester (atp-γ-S; adenosine |
| 3998 | | 5'-(3-thiotriphosphate); adenosine 5'-(γ-thiotriphosphate); |
| 3999 | | adenosine-5'-diphosphate monothiophosphate) |
| 4000 | | MG — magnesium ion |
| 4001 | | |
| 4002 | | |
| 4003 | | > modelfix |
| 4004 | | |
| 4005 | | Changed 71407 atom styles |
| 4006 | | 66312 atoms, 67574 bonds, 36 pseudobonds, 8215 residues, 6 models selected |
| 4007 | | |
| 4008 | | > newcolor #3/A #3/B #3/C #3/D #3/E #3/F #3/I #3/G #3/H |
| 4009 | | |
| 4010 | | > select #1/H,I |
| 4011 | | |
| 4012 | | 1476 atoms, 1654 bonds, 72 residues, 1 model selected |
| 4013 | | |
| 4014 | | > show #!1 models |
| 4015 | | |
| 4016 | | > ui mousemode right select |
| 4017 | | |
| 4018 | | > select clear |
| 4019 | | |
| 4020 | | > matchmaker #2,3 to #1 |
| 4021 | | |
| 4022 | | Computing secondary structure |
| 4023 | | Parameters |
| 4024 | | --- |
| 4025 | | Chain pairing | bb |
| 4026 | | Alignment algorithm | Needleman-Wunsch |
| 4027 | | Similarity matrix | BLOSUM-62 |
| 4028 | | SS fraction | 0.3 |
| 4029 | | Gap open (HH/SS/other) | 18/18/6 |
| 4030 | | Gap extend | 1 |
| 4031 | | SS matrix | | | H | S | O |
| 4032 | | ---|---|---|--- |
| 4033 | | H | 6 | -9 | -6 |
| 4034 | | S | | 6 | -6 |
| 4035 | | O | | | 4 |
| 4036 | | Iteration cutoff | 2 |
| 4037 | | |
| 4038 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain C (#1) with |
| 4039 | | hsORC1-6_CDC6_60bpDNA.pdb, chain C (#2), sequence alignment score = 967.1 |
| 4040 | | RMSD between 139 pruned atom pairs is 1.275 angstroms; (across all 568 pairs: |
| 4041 | | 7.882) |
| 4042 | | |
| 4043 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain A (#1) with 7mca- |
| 4044 | | assembly1.cif, chain A (#3), sequence alignment score = 943 |
| 4045 | | RMSD between 228 pruned atom pairs is 1.005 angstroms; (across all 394 pairs: |
| 4046 | | 5.169) |
| 4047 | | |
| 4048 | | |
| 4049 | | > matchmaker #2,3 to #1/C:180-260,/D,/E |
| 4050 | | |
| 4051 | | Invalid "to" argument: only initial part "#1/C:180-260" of atom specifier |
| 4052 | | valid |
| 4053 | | |
| 4054 | | > matchmaker #2,3 to (#1/C:140-300 | #1/D:360-end | #1/E:307-end) |
| 4055 | | |
| 4056 | | Computing secondary structure |
| 4057 | | Parameters |
| 4058 | | --- |
| 4059 | | Chain pairing | bb |
| 4060 | | Alignment algorithm | Needleman-Wunsch |
| 4061 | | Similarity matrix | BLOSUM-62 |
| 4062 | | SS fraction | 0.3 |
| 4063 | | Gap open (HH/SS/other) | 18/18/6 |
| 4064 | | Gap extend | 1 |
| 4065 | | SS matrix | | | H | S | O |
| 4066 | | ---|---|---|--- |
| 4067 | | H | 6 | -9 | -6 |
| 4068 | | S | | 6 | -6 |
| 4069 | | O | | | 4 |
| 4070 | | Iteration cutoff | 2 |
| 4071 | | |
| 4072 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain E (#1) with |
| 4073 | | hsORC1-6_CDC6_60bpDNA.pdb, chain E (#2), sequence alignment score = 281.2 |
| 4074 | | RMSD between 99 pruned atom pairs is 0.965 angstroms; (across all 120 pairs: |
| 4075 | | 3.490) |
| 4076 | | |
| 4077 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain E (#1) with 7mca- |
| 4078 | | assembly1.cif, chain E (#3), sequence alignment score = 312.4 |
| 4079 | | RMSD between 101 pruned atom pairs is 0.945 angstroms; (across all 138 pairs: |
| 4080 | | 3.466) |
| 4081 | | |
| 4082 | | |
| 4083 | | > matchmaker #2,3 to (#1/A:300-600 | #1/C:140-300 | #1/D:360-end | #1/E:307-end) |
| 4084 | | |
| 4085 | | Computing secondary structure |
| 4086 | | Parameters |
| 4087 | | --- |
| 4088 | | Chain pairing | bb |
| 4089 | | Alignment algorithm | Needleman-Wunsch |
| 4090 | | Similarity matrix | BLOSUM-62 |
| 4091 | | SS fraction | 0.3 |
| 4092 | | Gap open (HH/SS/other) | 18/18/6 |
| 4093 | | Gap extend | 1 |
| 4094 | | SS matrix | | | H | S | O |
| 4095 | | ---|---|---|--- |
| 4096 | | H | 6 | -9 | -6 |
| 4097 | | S | | 6 | -6 |
| 4098 | | O | | | 4 |
| 4099 | | Iteration cutoff | 2 |
| 4100 | | |
| 4101 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain A (#1) with |
| 4102 | | hsORC1-6_CDC6_60bpDNA.pdb, chain A (#2), sequence alignment score = 836.2 |
| 4103 | | RMSD between 200 pruned atom pairs is 1.167 angstroms; (across all 283 pairs: |
| 4104 | | 2.305) |
| 4105 | | |
| 4106 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain A (#1) with 7mca- |
| 4107 | | assembly1.cif, chain A (#3), sequence alignment score = 700.3 |
| 4108 | | RMSD between 218 pruned atom pairs is 0.943 angstroms; (across all 276 pairs: |
| 4109 | | 5.480) |
| 4110 | | |
| 4111 | | |
| 4112 | | > matchmaker #2,3 to (#1/A:400-600 | #1/C:140-300 | #1/D:360-end | #1/E:307-end) |
| 4113 | | |
| 4114 | | Computing secondary structure |
| 4115 | | Parameters |
| 4116 | | --- |
| 4117 | | Chain pairing | bb |
| 4118 | | Alignment algorithm | Needleman-Wunsch |
| 4119 | | Similarity matrix | BLOSUM-62 |
| 4120 | | SS fraction | 0.3 |
| 4121 | | Gap open (HH/SS/other) | 18/18/6 |
| 4122 | | Gap extend | 1 |
| 4123 | | SS matrix | | | H | S | O |
| 4124 | | ---|---|---|--- |
| 4125 | | H | 6 | -9 | -6 |
| 4126 | | S | | 6 | -6 |
| 4127 | | O | | | 4 |
| 4128 | | Iteration cutoff | 2 |
| 4129 | | |
| 4130 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain A (#1) with |
| 4131 | | hsORC1-6_CDC6_60bpDNA.pdb, chain A (#2), sequence alignment score = 582.4 |
| 4132 | | RMSD between 128 pruned atom pairs is 1.051 angstroms; (across all 196 pairs: |
| 4133 | | 2.238) |
| 4134 | | |
| 4135 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain A (#1) with 7mca- |
| 4136 | | assembly1.cif, chain A (#3), sequence alignment score = 527.5 |
| 4137 | | RMSD between 164 pruned atom pairs is 0.962 angstroms; (across all 191 pairs: |
| 4138 | | 2.175) |
| 4139 | | |
| 4140 | | |
| 4141 | | > matchmaker #2,3 to (#1/A:500-600 | #1/C:140-300 | #1/D:360-end | #1/E:307-end) |
| 4142 | | |
| 4143 | | Computing secondary structure |
| 4144 | | Parameters |
| 4145 | | --- |
| 4146 | | Chain pairing | bb |
| 4147 | | Alignment algorithm | Needleman-Wunsch |
| 4148 | | Similarity matrix | BLOSUM-62 |
| 4149 | | SS fraction | 0.3 |
| 4150 | | Gap open (HH/SS/other) | 18/18/6 |
| 4151 | | Gap extend | 1 |
| 4152 | | SS matrix | | | H | S | O |
| 4153 | | ---|---|---|--- |
| 4154 | | H | 6 | -9 | -6 |
| 4155 | | S | | 6 | -6 |
| 4156 | | O | | | 4 |
| 4157 | | Iteration cutoff | 2 |
| 4158 | | |
| 4159 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain A (#1) with |
| 4160 | | hsORC1-6_CDC6_60bpDNA.pdb, chain A (#2), sequence alignment score = 284.5 |
| 4161 | | RMSD between 68 pruned atom pairs is 1.060 angstroms; (across all 96 pairs: |
| 4162 | | 2.171) |
| 4163 | | |
| 4164 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain E (#1) with 7mca- |
| 4165 | | assembly1.cif, chain E (#3), sequence alignment score = 312.4 |
| 4166 | | RMSD between 101 pruned atom pairs is 0.945 angstroms; (across all 138 pairs: |
| 4167 | | 3.466) |
| 4168 | | |
| 4169 | | |
| 4170 | | > matchmaker #2,3 to (#1/A:400-600 | #1/C:140-300 | #1/D:360-end | #1/E:307-end) |
| 4171 | | |
| 4172 | | Computing secondary structure |
| 4173 | | Parameters |
| 4174 | | --- |
| 4175 | | Chain pairing | bb |
| 4176 | | Alignment algorithm | Needleman-Wunsch |
| 4177 | | Similarity matrix | BLOSUM-62 |
| 4178 | | SS fraction | 0.3 |
| 4179 | | Gap open (HH/SS/other) | 18/18/6 |
| 4180 | | Gap extend | 1 |
| 4181 | | SS matrix | | | H | S | O |
| 4182 | | ---|---|---|--- |
| 4183 | | H | 6 | -9 | -6 |
| 4184 | | S | | 6 | -6 |
| 4185 | | O | | | 4 |
| 4186 | | Iteration cutoff | 2 |
| 4187 | | |
| 4188 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain A (#1) with |
| 4189 | | hsORC1-6_CDC6_60bpDNA.pdb, chain A (#2), sequence alignment score = 582.4 |
| 4190 | | RMSD between 128 pruned atom pairs is 1.051 angstroms; (across all 196 pairs: |
| 4191 | | 2.238) |
| 4192 | | |
| 4193 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain A (#1) with 7mca- |
| 4194 | | assembly1.cif, chain A (#3), sequence alignment score = 527.5 |
| 4195 | | RMSD between 164 pruned atom pairs is 0.962 angstroms; (across all 191 pairs: |
| 4196 | | 2.175) |
| 4197 | | |
| 4198 | | |
| 4199 | | > select ~nucleic |
| 4200 | | |
| 4201 | | 66692 atoms, 67966 bonds, 38 pseudobonds, 8239 residues, 7 models selected |
| 4202 | | |
| 4203 | | > show sel surfaces |
| 4204 | | |
| 4205 | | > transparency 30 surfaces |
| 4206 | | |
| 4207 | | > transparency 70 surfaces |
| 4208 | | |
| 4209 | | > hide sel cartoons |
| 4210 | | |
| 4211 | | > matchmaker #2,3 to (#1/A:500-600 | #1/C:140-300 | #1/D:360-end | #1/E:307-end) |
| 4212 | | |
| 4213 | | Computing secondary structure |
| 4214 | | Parameters |
| 4215 | | --- |
| 4216 | | Chain pairing | bb |
| 4217 | | Alignment algorithm | Needleman-Wunsch |
| 4218 | | Similarity matrix | BLOSUM-62 |
| 4219 | | SS fraction | 0.3 |
| 4220 | | Gap open (HH/SS/other) | 18/18/6 |
| 4221 | | Gap extend | 1 |
| 4222 | | SS matrix | | | H | S | O |
| 4223 | | ---|---|---|--- |
| 4224 | | H | 6 | -9 | -6 |
| 4225 | | S | | 6 | -6 |
| 4226 | | O | | | 4 |
| 4227 | | Iteration cutoff | 2 |
| 4228 | | |
| 4229 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain A (#1) with |
| 4230 | | hsORC1-6_CDC6_60bpDNA.pdb, chain A (#2), sequence alignment score = 284.5 |
| 4231 | | RMSD between 68 pruned atom pairs is 1.060 angstroms; (across all 96 pairs: |
| 4232 | | 2.171) |
| 4233 | | |
| 4234 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain E (#1) with 7mca- |
| 4235 | | assembly1.cif, chain E (#3), sequence alignment score = 312.4 |
| 4236 | | RMSD between 101 pruned atom pairs is 0.945 angstroms; (across all 138 pairs: |
| 4237 | | 3.466) |
| 4238 | | |
| 4239 | | |
| 4240 | | > matchmaker #2,3 to (#1/A:400-600 | #1/C:140-300 | #1/D:360-end | #1/E:307-end) |
| 4241 | | |
| 4242 | | Computing secondary structure |
| 4243 | | Parameters |
| 4244 | | --- |
| 4245 | | Chain pairing | bb |
| 4246 | | Alignment algorithm | Needleman-Wunsch |
| 4247 | | Similarity matrix | BLOSUM-62 |
| 4248 | | SS fraction | 0.3 |
| 4249 | | Gap open (HH/SS/other) | 18/18/6 |
| 4250 | | Gap extend | 1 |
| 4251 | | SS matrix | | | H | S | O |
| 4252 | | ---|---|---|--- |
| 4253 | | H | 6 | -9 | -6 |
| 4254 | | S | | 6 | -6 |
| 4255 | | O | | | 4 |
| 4256 | | Iteration cutoff | 2 |
| 4257 | | |
| 4258 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain A (#1) with |
| 4259 | | hsORC1-6_CDC6_60bpDNA.pdb, chain A (#2), sequence alignment score = 582.4 |
| 4260 | | RMSD between 128 pruned atom pairs is 1.051 angstroms; (across all 196 pairs: |
| 4261 | | 2.238) |
| 4262 | | |
| 4263 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain A (#1) with 7mca- |
| 4264 | | assembly1.cif, chain A (#3), sequence alignment score = 527.5 |
| 4265 | | RMSD between 164 pruned atom pairs is 0.962 angstroms; (across all 191 pairs: |
| 4266 | | 2.175) |
| 4267 | | |
| 4268 | | |
| 4269 | | > matchmaker #2,3 to (#1/A:400-600 | #1/C:140-300 | #1/D:360-end | #1/E:307-end) |
| 4270 | | |
| 4271 | | Computing secondary structure |
| 4272 | | Parameters |
| 4273 | | --- |
| 4274 | | Chain pairing | bb |
| 4275 | | Alignment algorithm | Needleman-Wunsch |
| 4276 | | Similarity matrix | BLOSUM-62 |
| 4277 | | SS fraction | 0.3 |
| 4278 | | Gap open (HH/SS/other) | 18/18/6 |
| 4279 | | Gap extend | 1 |
| 4280 | | SS matrix | | | H | S | O |
| 4281 | | ---|---|---|--- |
| 4282 | | H | 6 | -9 | -6 |
| 4283 | | S | | 6 | -6 |
| 4284 | | O | | | 4 |
| 4285 | | Iteration cutoff | 2 |
| 4286 | | |
| 4287 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain A (#1) with |
| 4288 | | hsORC1-6_CDC6_60bpDNA.pdb, chain A (#2), sequence alignment score = 582.4 |
| 4289 | | RMSD between 128 pruned atom pairs is 1.051 angstroms; (across all 196 pairs: |
| 4290 | | 2.238) |
| 4291 | | |
| 4292 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain A (#1) with 7mca- |
| 4293 | | assembly1.cif, chain A (#3), sequence alignment score = 527.5 |
| 4294 | | RMSD between 164 pruned atom pairs is 0.962 angstroms; (across all 191 pairs: |
| 4295 | | 2.175) |
| 4296 | | |
| 4297 | | |
| 4298 | | > matchmaker #2,3 to #1 |
| 4299 | | |
| 4300 | | Computing secondary structure |
| 4301 | | Parameters |
| 4302 | | --- |
| 4303 | | Chain pairing | bb |
| 4304 | | Alignment algorithm | Needleman-Wunsch |
| 4305 | | Similarity matrix | BLOSUM-62 |
| 4306 | | SS fraction | 0.3 |
| 4307 | | Gap open (HH/SS/other) | 18/18/6 |
| 4308 | | Gap extend | 1 |
| 4309 | | SS matrix | | | H | S | O |
| 4310 | | ---|---|---|--- |
| 4311 | | H | 6 | -9 | -6 |
| 4312 | | S | | 6 | -6 |
| 4313 | | O | | | 4 |
| 4314 | | Iteration cutoff | 2 |
| 4315 | | |
| 4316 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain C (#1) with |
| 4317 | | hsORC1-6_CDC6_60bpDNA.pdb, chain C (#2), sequence alignment score = 967.1 |
| 4318 | | RMSD between 139 pruned atom pairs is 1.275 angstroms; (across all 568 pairs: |
| 4319 | | 7.882) |
| 4320 | | |
| 4321 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain A (#1) with 7mca- |
| 4322 | | assembly1.cif, chain A (#3), sequence alignment score = 943 |
| 4323 | | RMSD between 228 pruned atom pairs is 1.005 angstroms; (across all 394 pairs: |
| 4324 | | 5.169) |
| 4325 | | |
| 4326 | | Drag select of ylODC_54bpOriC061_rev29_PostPhenix.pdb_A SES surface, 7 of |
| 4327 | | 358676 triangles, ylODC_54bpOriC061_rev29_PostPhenix.pdb_D SES surface, 18 of |
| 4328 | | 396086 triangles, hsORC1-6_CDC6_60bpDNA.pdb_D SES surface, 38 of 440036 |
| 4329 | | triangles |
| 4330 | | |
| 4331 | | > select #2/A:901@C5' |
| 4332 | | |
| 4333 | | 1 atom, 1 residue, 1 model selected |
| 4334 | | |
| 4335 | | > select up |
| 4336 | | |
| 4337 | | 31 atoms, 33 bonds, 1 residue, 1 model selected |
| 4338 | | |
| 4339 | | > select up |
| 4340 | | |
| 4341 | | 3061 atoms, 3113 bonds, 385 residues, 1 model selected |
| 4342 | | |
| 4343 | | > select down |
| 4344 | | |
| 4345 | | 31 atoms, 33 bonds, 1 residue, 2 models selected |
| 4346 | | |
| 4347 | | > select clear |
| 4348 | | |
| 4349 | | > matchmaker #2,3 to (#1/A:500-600 | #1/C:140-300 | #1/D:360-end | #1/E:307-end) |
| 4350 | | |
| 4351 | | Computing secondary structure |
| 4352 | | Parameters |
| 4353 | | --- |
| 4354 | | Chain pairing | bb |
| 4355 | | Alignment algorithm | Needleman-Wunsch |
| 4356 | | Similarity matrix | BLOSUM-62 |
| 4357 | | SS fraction | 0.3 |
| 4358 | | Gap open (HH/SS/other) | 18/18/6 |
| 4359 | | Gap extend | 1 |
| 4360 | | SS matrix | | | H | S | O |
| 4361 | | ---|---|---|--- |
| 4362 | | H | 6 | -9 | -6 |
| 4363 | | S | | 6 | -6 |
| 4364 | | O | | | 4 |
| 4365 | | Iteration cutoff | 2 |
| 4366 | | |
| 4367 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain A (#1) with |
| 4368 | | hsORC1-6_CDC6_60bpDNA.pdb, chain A (#2), sequence alignment score = 284.5 |
| 4369 | | RMSD between 68 pruned atom pairs is 1.060 angstroms; (across all 96 pairs: |
| 4370 | | 2.171) |
| 4371 | | |
| 4372 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain E (#1) with 7mca- |
| 4373 | | assembly1.cif, chain E (#3), sequence alignment score = 312.4 |
| 4374 | | RMSD between 101 pruned atom pairs is 0.945 angstroms; (across all 138 pairs: |
| 4375 | | 3.466) |
| 4376 | | |
| 4377 | | |
| 4378 | | > matchmaker #2,3 to (#1/A:400-600 | #1/C:140-300 | #1/D:360-end | #1/E:307-end) |
| 4379 | | |
| 4380 | | Computing secondary structure |
| 4381 | | Parameters |
| 4382 | | --- |
| 4383 | | Chain pairing | bb |
| 4384 | | Alignment algorithm | Needleman-Wunsch |
| 4385 | | Similarity matrix | BLOSUM-62 |
| 4386 | | SS fraction | 0.3 |
| 4387 | | Gap open (HH/SS/other) | 18/18/6 |
| 4388 | | Gap extend | 1 |
| 4389 | | SS matrix | | | H | S | O |
| 4390 | | ---|---|---|--- |
| 4391 | | H | 6 | -9 | -6 |
| 4392 | | S | | 6 | -6 |
| 4393 | | O | | | 4 |
| 4394 | | Iteration cutoff | 2 |
| 4395 | | |
| 4396 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain A (#1) with |
| 4397 | | hsORC1-6_CDC6_60bpDNA.pdb, chain A (#2), sequence alignment score = 582.4 |
| 4398 | | RMSD between 128 pruned atom pairs is 1.051 angstroms; (across all 196 pairs: |
| 4399 | | 2.238) |
| 4400 | | |
| 4401 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain A (#1) with 7mca- |
| 4402 | | assembly1.cif, chain A (#3), sequence alignment score = 527.5 |
| 4403 | | RMSD between 164 pruned atom pairs is 0.962 angstroms; (across all 191 pairs: |
| 4404 | | 2.175) |
| 4405 | | |
| 4406 | | |
| 4407 | | > matchmaker #2,3 to #1 |
| 4408 | | |
| 4409 | | Computing secondary structure |
| 4410 | | Parameters |
| 4411 | | --- |
| 4412 | | Chain pairing | bb |
| 4413 | | Alignment algorithm | Needleman-Wunsch |
| 4414 | | Similarity matrix | BLOSUM-62 |
| 4415 | | SS fraction | 0.3 |
| 4416 | | Gap open (HH/SS/other) | 18/18/6 |
| 4417 | | Gap extend | 1 |
| 4418 | | SS matrix | | | H | S | O |
| 4419 | | ---|---|---|--- |
| 4420 | | H | 6 | -9 | -6 |
| 4421 | | S | | 6 | -6 |
| 4422 | | O | | | 4 |
| 4423 | | Iteration cutoff | 2 |
| 4424 | | |
| 4425 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain C (#1) with |
| 4426 | | hsORC1-6_CDC6_60bpDNA.pdb, chain C (#2), sequence alignment score = 967.1 |
| 4427 | | RMSD between 139 pruned atom pairs is 1.275 angstroms; (across all 568 pairs: |
| 4428 | | 7.882) |
| 4429 | | |
| 4430 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain A (#1) with 7mca- |
| 4431 | | assembly1.cif, chain A (#3), sequence alignment score = 943 |
| 4432 | | RMSD between 228 pruned atom pairs is 1.005 angstroms; (across all 394 pairs: |
| 4433 | | 5.169) |
| 4434 | | |
| 4435 | | |
| 4436 | | > matchmaker #2,3 to (#1/A:400-600 | #1/C:140-300 | #1/D:360-end | #1/E:307-end) |
| 4437 | | |
| 4438 | | Computing secondary structure |
| 4439 | | Parameters |
| 4440 | | --- |
| 4441 | | Chain pairing | bb |
| 4442 | | Alignment algorithm | Needleman-Wunsch |
| 4443 | | Similarity matrix | BLOSUM-62 |
| 4444 | | SS fraction | 0.3 |
| 4445 | | Gap open (HH/SS/other) | 18/18/6 |
| 4446 | | Gap extend | 1 |
| 4447 | | SS matrix | | | H | S | O |
| 4448 | | ---|---|---|--- |
| 4449 | | H | 6 | -9 | -6 |
| 4450 | | S | | 6 | -6 |
| 4451 | | O | | | 4 |
| 4452 | | Iteration cutoff | 2 |
| 4453 | | |
| 4454 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain A (#1) with |
| 4455 | | hsORC1-6_CDC6_60bpDNA.pdb, chain A (#2), sequence alignment score = 582.4 |
| 4456 | | RMSD between 128 pruned atom pairs is 1.051 angstroms; (across all 196 pairs: |
| 4457 | | 2.238) |
| 4458 | | |
| 4459 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain A (#1) with 7mca- |
| 4460 | | assembly1.cif, chain A (#3), sequence alignment score = 527.5 |
| 4461 | | RMSD between 164 pruned atom pairs is 0.962 angstroms; (across all 191 pairs: |
| 4462 | | 2.175) |
| 4463 | | |
| 4464 | | |
| 4465 | | > select #2 |
| 4466 | | |
| 4467 | | 21416 atoms, 21948 bonds, 13 pseudobonds, 2551 residues, 2 models selected |
| 4468 | | |
| 4469 | | > show sel atoms |
| 4470 | | |
| 4471 | | > undo |
| 4472 | | |
| 4473 | | > show sel cartoons |
| 4474 | | |
| 4475 | | > select clear |
| 4476 | | |
| 4477 | | > matchmaker #2,3 to #1 |
| 4478 | | |
| 4479 | | Computing secondary structure |
| 4480 | | Parameters |
| 4481 | | --- |
| 4482 | | Chain pairing | bb |
| 4483 | | Alignment algorithm | Needleman-Wunsch |
| 4484 | | Similarity matrix | BLOSUM-62 |
| 4485 | | SS fraction | 0.3 |
| 4486 | | Gap open (HH/SS/other) | 18/18/6 |
| 4487 | | Gap extend | 1 |
| 4488 | | SS matrix | | | H | S | O |
| 4489 | | ---|---|---|--- |
| 4490 | | H | 6 | -9 | -6 |
| 4491 | | S | | 6 | -6 |
| 4492 | | O | | | 4 |
| 4493 | | Iteration cutoff | 2 |
| 4494 | | |
| 4495 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain C (#1) with |
| 4496 | | hsORC1-6_CDC6_60bpDNA.pdb, chain C (#2), sequence alignment score = 967.1 |
| 4497 | | RMSD between 139 pruned atom pairs is 1.275 angstroms; (across all 568 pairs: |
| 4498 | | 7.882) |
| 4499 | | |
| 4500 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain A (#1) with 7mca- |
| 4501 | | assembly1.cif, chain A (#3), sequence alignment score = 943 |
| 4502 | | RMSD between 228 pruned atom pairs is 1.005 angstroms; (across all 394 pairs: |
| 4503 | | 5.169) |
| 4504 | | |
| 4505 | | |
| 4506 | | > matchmaker #2,3 to (#1/A:400-600 | #1/C:140-300 | #1/D:360-end | #1/E:307-end) |
| 4507 | | |
| 4508 | | Computing secondary structure |
| 4509 | | Parameters |
| 4510 | | --- |
| 4511 | | Chain pairing | bb |
| 4512 | | Alignment algorithm | Needleman-Wunsch |
| 4513 | | Similarity matrix | BLOSUM-62 |
| 4514 | | SS fraction | 0.3 |
| 4515 | | Gap open (HH/SS/other) | 18/18/6 |
| 4516 | | Gap extend | 1 |
| 4517 | | SS matrix | | | H | S | O |
| 4518 | | ---|---|---|--- |
| 4519 | | H | 6 | -9 | -6 |
| 4520 | | S | | 6 | -6 |
| 4521 | | O | | | 4 |
| 4522 | | Iteration cutoff | 2 |
| 4523 | | |
| 4524 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain A (#1) with |
| 4525 | | hsORC1-6_CDC6_60bpDNA.pdb, chain A (#2), sequence alignment score = 582.4 |
| 4526 | | RMSD between 128 pruned atom pairs is 1.051 angstroms; (across all 196 pairs: |
| 4527 | | 2.238) |
| 4528 | | |
| 4529 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain A (#1) with 7mca- |
| 4530 | | assembly1.cif, chain A (#3), sequence alignment score = 527.5 |
| 4531 | | RMSD between 164 pruned atom pairs is 0.962 angstroms; (across all 191 pairs: |
| 4532 | | 2.175) |
| 4533 | | |
| 4534 | | |
| 4535 | | > hide #!2 models |
| 4536 | | |
| 4537 | | > show #!2 models |
| 4538 | | |
| 4539 | | > hide #!2 models |
| 4540 | | |
| 4541 | | > show #!2 models |
| 4542 | | |
| 4543 | | > select add #2 |
| 4544 | | |
| 4545 | | 21416 atoms, 21948 bonds, 13 pseudobonds, 2551 residues, 2 models selected |
| 4546 | | |
| 4547 | | > hide sel surfaces |
| 4548 | | |
| 4549 | | > select clear |
| 4550 | | |
| 4551 | | > matchmaker #2,3 to #1 |
| 4552 | | |
| 4553 | | Computing secondary structure |
| 4554 | | Parameters |
| 4555 | | --- |
| 4556 | | Chain pairing | bb |
| 4557 | | Alignment algorithm | Needleman-Wunsch |
| 4558 | | Similarity matrix | BLOSUM-62 |
| 4559 | | SS fraction | 0.3 |
| 4560 | | Gap open (HH/SS/other) | 18/18/6 |
| 4561 | | Gap extend | 1 |
| 4562 | | SS matrix | | | H | S | O |
| 4563 | | ---|---|---|--- |
| 4564 | | H | 6 | -9 | -6 |
| 4565 | | S | | 6 | -6 |
| 4566 | | O | | | 4 |
| 4567 | | Iteration cutoff | 2 |
| 4568 | | |
| 4569 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain C (#1) with |
| 4570 | | hsORC1-6_CDC6_60bpDNA.pdb, chain C (#2), sequence alignment score = 967.1 |
| 4571 | | RMSD between 139 pruned atom pairs is 1.275 angstroms; (across all 568 pairs: |
| 4572 | | 7.882) |
| 4573 | | |
| 4574 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain A (#1) with 7mca- |
| 4575 | | assembly1.cif, chain A (#3), sequence alignment score = 943 |
| 4576 | | RMSD between 228 pruned atom pairs is 1.005 angstroms; (across all 394 pairs: |
| 4577 | | 5.169) |
| 4578 | | |
| 4579 | | |
| 4580 | | > matchmaker #2,3 to (#1/A:400-600 | #1/C:140-300 | #1/D:360-end | #1/E:307-end) |
| 4581 | | |
| 4582 | | Computing secondary structure |
| 4583 | | Parameters |
| 4584 | | --- |
| 4585 | | Chain pairing | bb |
| 4586 | | Alignment algorithm | Needleman-Wunsch |
| 4587 | | Similarity matrix | BLOSUM-62 |
| 4588 | | SS fraction | 0.3 |
| 4589 | | Gap open (HH/SS/other) | 18/18/6 |
| 4590 | | Gap extend | 1 |
| 4591 | | SS matrix | | | H | S | O |
| 4592 | | ---|---|---|--- |
| 4593 | | H | 6 | -9 | -6 |
| 4594 | | S | | 6 | -6 |
| 4595 | | O | | | 4 |
| 4596 | | Iteration cutoff | 2 |
| 4597 | | |
| 4598 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain A (#1) with |
| 4599 | | hsORC1-6_CDC6_60bpDNA.pdb, chain A (#2), sequence alignment score = 582.4 |
| 4600 | | RMSD between 128 pruned atom pairs is 1.051 angstroms; (across all 196 pairs: |
| 4601 | | 2.238) |
| 4602 | | |
| 4603 | | Matchmaker ylODC_54bpOriC061_rev29_PostPhenix.pdb, chain A (#1) with 7mca- |
| 4604 | | assembly1.cif, chain A (#3), sequence alignment score = 527.5 |
| 4605 | | RMSD between 164 pruned atom pairs is 0.962 angstroms; (across all 191 pairs: |
| 4606 | | 2.175) |
| 4607 | | |
| 4608 | | |
| 4609 | | > select add #2 |
| 4610 | | |
| 4611 | | 21416 atoms, 21948 bonds, 13 pseudobonds, 2551 residues, 2 models selected |
| 4612 | | |
| 4613 | | > select ~nucleic |
| 4614 | | |
| 4615 | | 66692 atoms, 67966 bonds, 38 pseudobonds, 8239 residues, 7 models selected |
| 4616 | | |
| 4617 | | > show sel surfaces |
| 4618 | | |
| 4619 | | > select clear |
| 4620 | | |
| 4621 | | > select ~nucleic |
| 4622 | | |
| 4623 | | 66692 atoms, 67966 bonds, 38 pseudobonds, 8239 residues, 7 models selected |
| 4624 | | |
| 4625 | | > hide sel cartoons |
| 4626 | | |
| 4627 | | > hide sel atoms |
| 4628 | | |
| 4629 | | > select clear |
| 4630 | | |
| 4631 | | > color #1 FFFF80 |
| 4632 | | |
| 4633 | | Expected a color or one of 'byatom', 'bychain', 'byelement', 'byhetero', |
| 4634 | | 'byidentity', 'bymodel', 'bynucleotide', 'bypolymer', 'fromatoms', |
| 4635 | | 'fromcartoons', 'fromribbons', or 'random' or a keyword |
| 4636 | | |
| 4637 | | > color #1 #FFFF80 |
| 4638 | | |
| 4639 | | > color #1 #FF8080 |
| 4640 | | |
| 4641 | | > color #2 #8080FF |
| 4642 | | |
| 4643 | | > color #2 #0080FF |
| 4644 | | |
| 4645 | | > color #3 #0080FF |
| 4646 | | |
| 4647 | | > color #3 lime |
| 4648 | | |
| 4649 | | > lighting full |
| 4650 | | |
| 4651 | | > graphics silhouettes false |
| 4652 | | |
| 4653 | | > lighting shadows false |
| 4654 | | |
| 4655 | | > lighting shadows true |
| 4656 | | |
| 4657 | | > lighting full |
| 4658 | | |
| 4659 | | > transparency 75 surfaces |
| 4660 | | |
| 4661 | | > hide #!2 models |
| 4662 | | |
| 4663 | | > hide #!3 models |
| 4664 | | |
| 4665 | | > show #!2 models |
| 4666 | | |
| 4667 | | > show #!3 models |
| 4668 | | |
| 4669 | | > nucleotides atoms |
| 4670 | | |
| 4671 | | > style nucleic stick |
| 4672 | | |
| 4673 | | Changed 4715 atom styles |
| 4674 | | |
| 4675 | | > nucleotides fill |
| 4676 | | |
| 4677 | | > style nucleic stick |
| 4678 | | |
| 4679 | | Changed 4715 atom styles |
| 4680 | | |
| 4681 | | > nucleotides tube/slab shape box |
| 4682 | | |
| 4683 | | > hide #!2 models |
| 4684 | | |
| 4685 | | > hide #!3 models |
| 4686 | | |
| 4687 | | > show #!3 models |
| 4688 | | |
| 4689 | | > show #!2 models |
| 4690 | | |
| 4691 | | > hide #!2 models |
| 4692 | | |
| 4693 | | > hide #!1 models |
| 4694 | | |
| 4695 | | > show #!1 models |
| 4696 | | |
| 4697 | | > show #!2 models |
| 4698 | | |
| 4699 | | > lighting soft |
| 4700 | | |
| 4701 | | > hide #!2 models |
| 4702 | | |
| 4703 | | > hide #!1 models |
| 4704 | | |
| 4705 | | > | #3/I) /Z /Z |
| 4706 | | |
| 4707 | | Expected fewer arguments |
| 4708 | | |
| 4709 | | > |
| 4710 | | |
| 4711 | | Missing or invalid eighth argument: Expected a text string |
| 4712 | | |
| 4713 | | > newcolor /A /B /C /D /E /F #1/G /Z /Z |
| 4714 | | |
| 4715 | | > newcolor /A /B /C /D /E /F #2/G /Z /Z |
| 4716 | | |
| 4717 | | > newcolor /A /B /C /D /E /F #3/I /Z /Z |
| 4718 | | |
| 4719 | | > transparency 75 surfaces |
| 4720 | | |
| 4721 | | > show #!2 models |
| 4722 | | |
| 4723 | | > hide #!3 models |
| 4724 | | |
| 4725 | | > show #!3 models |
| 4726 | | |
| 4727 | | > hide #!2 models |
| 4728 | | |
| 4729 | | > hide #!3 models |
| 4730 | | |
| 4731 | | > show #!2 models |
| 4732 | | |
| 4733 | | > show #!3 models |
| 4734 | | |
| 4735 | | > color #3 #0080FF |
| 4736 | | |
| 4737 | | > color #2 lime |
| 4738 | | |
| 4739 | | > newcolor /A /B /C /D /E /F #3/I /Z /Z |
| 4740 | | |
| 4741 | | > newcolor /A /B /C /D /E /F #2/G /Z /Z |
| 4742 | | |
| 4743 | | > transparency 75 surfaces |
| 4744 | | |
| 4745 | | > hide #!3 models |
| 4746 | | |
| 4747 | | > hide #!2 models |
| 4748 | | |
| 4749 | | > show #!1 models |
| 4750 | | |
| 4751 | | > show #!2 models |
| 4752 | | |
| 4753 | | > show #!3 models |
| 4754 | | |
| 4755 | | > hide #!2 models |
| 4756 | | |
| 4757 | | > hide #!3 models |
| 4758 | | |
| 4759 | | > show #!2 models |
| 4760 | | |
| 4761 | | > show #!3 models |
| 4762 | | |
| 4763 | | > hide #!2 models |
| 4764 | | |
| 4765 | | > hide #!3 models |
| 4766 | | |
| 4767 | | > save "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 4768 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/figures for |
| 4769 | | > posterpub/ylODC_54oriC_bend_updated.png" supersample 3 |
| 4770 | | |
| 4771 | | > show #!2 models |
| 4772 | | |
| 4773 | | > hide #!1 models |
| 4774 | | |
| 4775 | | > save "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 4776 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/figures for |
| 4777 | | > posterpub/hsODC_bend_updated.png" supersample 3 |
| 4778 | | |
| 4779 | | > show #!3 models |
| 4780 | | |
| 4781 | | > hide #!2 models |
| 4782 | | |
| 4783 | | > save "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 4784 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/figures for |
| 4785 | | > posterpub/scODC_bend_updated.png" supersample 3 |
| 4786 | | |
| 4787 | | > show #!1 models |
| 4788 | | |
| 4789 | | > show #!2 models |
| 4790 | | |
| 4791 | | > transparency 50 surfaces |
| 4792 | | |
| 4793 | | > hide #!2 models |
| 4794 | | |
| 4795 | | > hide #!3 models |
| 4796 | | |
| 4797 | | > save "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 4798 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/figures for |
| 4799 | | > posterpub/ylODC_54oriC_bend_updated2.png" supersample 3 |
| 4800 | | |
| 4801 | | > show #!2 models |
| 4802 | | |
| 4803 | | > hide #!1 models |
| 4804 | | |
| 4805 | | > save "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 4806 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/figures for |
| 4807 | | > posterpub/hsODC_bend_updated2.png" supersample 3 |
| 4808 | | |
| 4809 | | > hide #!2 models |
| 4810 | | |
| 4811 | | > show #!3 models |
| 4812 | | |
| 4813 | | > save "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 4814 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/figures for |
| 4815 | | > posterpub/scODC_bend_updated2.png" supersample 3 |
| 4816 | | |
| 4817 | | > ui tool show "Side View" |
| 4818 | | |
| 4819 | | > show #!1 models |
| 4820 | | |
| 4821 | | > hide #!3 models |
| 4822 | | |
| 4823 | | > show #!2 models |
| 4824 | | |
| 4825 | | > hide #!1 models |
| 4826 | | |
| 4827 | | > lighting full |
| 4828 | | |
| 4829 | | > show #!1 models |
| 4830 | | |
| 4831 | | > hide #!2 models |
| 4832 | | |
| 4833 | | > show #!3 models |
| 4834 | | |
| 4835 | | > hide #!1 models |
| 4836 | | |
| 4837 | | > show #!2 models |
| 4838 | | |
| 4839 | | > hide #!2 models |
| 4840 | | |
| 4841 | | > show #!2 models |
| 4842 | | |
| 4843 | | > hide #!2 models |
| 4844 | | |
| 4845 | | > show #!2 models |
| 4846 | | |
| 4847 | | > hide #!2 models |
| 4848 | | |
| 4849 | | > show #!2 models |
| 4850 | | |
| 4851 | | > hide #!2 models |
| 4852 | | |
| 4853 | | > show #!1 models |
| 4854 | | |
| 4855 | | > hide #!3 models |
| 4856 | | |
| 4857 | | > show #!2 models |
| 4858 | | |
| 4859 | | > hide #!2 models |
| 4860 | | |
| 4861 | | > show #!2 models |
| 4862 | | |
| 4863 | | > hide #!2 models |
| 4864 | | |
| 4865 | | > show #!2 models |
| 4866 | | |
| 4867 | | > hide #!1 models |
| 4868 | | |
| 4869 | | > show #!1 models |
| 4870 | | |
| 4871 | | > hide #!2 models |
| 4872 | | |
| 4873 | | > show #!2 models |
| 4874 | | |
| 4875 | | > hide #!2 models |
| 4876 | | |
| 4877 | | > show #!2 models |
| 4878 | | |
| 4879 | | > hide #!2 models |
| 4880 | | |
| 4881 | | > show #!2 models |
| 4882 | | |
| 4883 | | > hide #!2 models |
| 4884 | | |
| 4885 | | > show #!2 models |
| 4886 | | |
| 4887 | | > hide #!2 models |
| 4888 | | |
| 4889 | | > show #!2 models |
| 4890 | | |
| 4891 | | > show #!1-2 cartoons |
| 4892 | | |
| 4893 | | > hide #!1 models |
| 4894 | | |
| 4895 | | > show #!1 models |
| 4896 | | |
| 4897 | | > hide #!1 models |
| 4898 | | |
| 4899 | | > show #!1 models |
| 4900 | | |
| 4901 | | > close #2-3 |
| 4902 | | |
| 4903 | | > hide surfaces |
| 4904 | | |
| 4905 | | > select /A,B,C,E,F |
| 4906 | | |
| 4907 | | 16637 atoms, 16971 bonds, 4 pseudobonds, 2073 residues, 3 models selected |
| 4908 | | |
| 4909 | | > hide sel cartoons |
| 4910 | | |
| 4911 | | > select /D:465 |
| 4912 | | |
| 4913 | | 9 atoms, 8 bonds, 1 residue, 1 model selected |
| 4914 | | |
| 4915 | | > show sel atoms |
| 4916 | | |
| 4917 | | > select /G:557 |
| 4918 | | |
| 4919 | | 11 atoms, 10 bonds, 1 residue, 1 model selected |
| 4920 | | |
| 4921 | | > show sel atoms |
| 4922 | | |
| 4923 | | > select /G:548 |
| 4924 | | |
| 4925 | | 9 atoms, 8 bonds, 1 residue, 1 model selected |
| 4926 | | |
| 4927 | | > show sel atoms |
| 4928 | | |
| 4929 | | > select clear |
| 4930 | | |
| 4931 | | > lighting shadows false |
| 4932 | | |
| 4933 | | > modelfix |
| 4934 | | |
| 4935 | | Changed 25299 atom styles |
| 4936 | | 23699 atoms, 24145 bonds, 9 pseudobonds, 2970 residues, 2 models selected |
| 4937 | | |
| 4938 | | > select /A,B,C,E,F |
| 4939 | | |
| 4940 | | 16637 atoms, 16971 bonds, 4 pseudobonds, 2073 residues, 3 models selected |
| 4941 | | |
| 4942 | | > hide sel cartoons |
| 4943 | | |
| 4944 | | > select clear |
| 4945 | | |
| 4946 | | > select /D:465 |
| 4947 | | |
| 4948 | | 9 atoms, 8 bonds, 1 residue, 1 model selected |
| 4949 | | |
| 4950 | | > show sel atoms |
| 4951 | | |
| 4952 | | > select /G:560 |
| 4953 | | |
| 4954 | | 9 atoms, 8 bonds, 1 residue, 1 model selected |
| 4955 | | |
| 4956 | | > select /G:557 |
| 4957 | | |
| 4958 | | 11 atoms, 10 bonds, 1 residue, 1 model selected |
| 4959 | | |
| 4960 | | > show sel atoms |
| 4961 | | |
| 4962 | | > select /G:548 |
| 4963 | | |
| 4964 | | 9 atoms, 8 bonds, 1 residue, 1 model selected |
| 4965 | | |
| 4966 | | > show sel atoms |
| 4967 | | |
| 4968 | | > select clear |
| 4969 | | |
| 4970 | | > nucleotides tube/slab shape box |
| 4971 | | |
| 4972 | | > nucleotides fill |
| 4973 | | |
| 4974 | | > style nucleic stick |
| 4975 | | |
| 4976 | | Changed 1476 atom styles |
| 4977 | | |
| 4978 | | > nucleotides fill |
| 4979 | | |
| 4980 | | > style nucleic stick |
| 4981 | | |
| 4982 | | Changed 1476 atom styles |
| 4983 | | |
| 4984 | | > nucleotides ladder |
| 4985 | | |
| 4986 | | > nucleotides fill |
| 4987 | | |
| 4988 | | > style nucleic stick |
| 4989 | | |
| 4990 | | Changed 1476 atom styles |
| 4991 | | |
| 4992 | | > nucleotides fill |
| 4993 | | |
| 4994 | | > style nucleic stick |
| 4995 | | |
| 4996 | | Changed 1476 atom styles |
| 4997 | | |
| 4998 | | > nucleotides atoms |
| 4999 | | |
| 5000 | | > style nucleic stick |
| 5001 | | |
| 5002 | | Changed 1476 atom styles |
| 5003 | | |
| 5004 | | > select clear |
| 5005 | | |
| 5006 | | > save "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 5007 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/figures for |
| 5008 | | > posterpub/Orc4-Cdc6-element-54bpOriC061-ver1.png" supersample 3 |
| 5009 | | |
| 5010 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 5011 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 5012 | | > structures/PDBs/ylODC_54bp- |
| 5013 | | > oriC061_complete/ylODC_54bpOriC061_rev30_PostPhenix.pdb" |
| 5014 | | |
| 5015 | | Chain information for ylODC_54bpOriC061_rev30_PostPhenix.pdb #2 |
| 5016 | | --- |
| 5017 | | Chain | Description |
| 5018 | | A | No description available |
| 5019 | | B | No description available |
| 5020 | | C | No description available |
| 5021 | | D | No description available |
| 5022 | | E | No description available |
| 5023 | | F | No description available |
| 5024 | | G | No description available |
| 5025 | | H | No description available |
| 5026 | | I | No description available |
| 5027 | | |
| 5028 | | |
| 5029 | | > modelfix |
| 5030 | | |
| 5031 | | Changed 50598 atom styles |
| 5032 | | 47398 atoms, 48290 bonds, 18 pseudobonds, 5940 residues, 4 models selected |
| 5033 | | |
| 5034 | | > select /A,B,C,E,F |
| 5035 | | |
| 5036 | | 33274 atoms, 33942 bonds, 8 pseudobonds, 4146 residues, 6 models selected |
| 5037 | | |
| 5038 | | > hide sel cartoons |
| 5039 | | |
| 5040 | | > select ~nucleic |
| 5041 | | |
| 5042 | | 47646 atoms, 48546 bonds, 22 pseudobonds, 5956 residues, 6 models selected |
| 5043 | | |
| 5044 | | > hide sel atoms |
| 5045 | | |
| 5046 | | > select clear |
| 5047 | | |
| 5048 | | Drag select of 10 residues |
| 5049 | | |
| 5050 | | > select clear |
| 5051 | | |
| 5052 | | Drag select of 2 residues |
| 5053 | | |
| 5054 | | > show sel atoms |
| 5055 | | |
| 5056 | | > select #2/D:465@NZ |
| 5057 | | |
| 5058 | | 1 atom, 1 residue, 1 model selected |
| 5059 | | |
| 5060 | | > ui tool show "Add Hydrogens" |
| 5061 | | |
| 5062 | | > addh #!2 |
| 5063 | | |
| 5064 | | Summary of feedback from adding hydrogens to |
| 5065 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2 |
| 5066 | | --- |
| 5067 | | warnings | Not adding hydrogens to ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/H DG 8 P because it is missing heavy-atom bond partners |
| 5068 | | Not adding hydrogens to ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/I DG 13 P |
| 5069 | | because it is missing heavy-atom bond partners |
| 5070 | | notes | Termini for ylODC_54bpOriC061_rev30_PostPhenix.pdb (#2) chain A determined from SEQRES records |
| 5071 | | Termini for ylODC_54bpOriC061_rev30_PostPhenix.pdb (#2) chain B determined |
| 5072 | | from SEQRES records |
| 5073 | | No usable SEQRES records for ylODC_54bpOriC061_rev30_PostPhenix.pdb (#2) chain |
| 5074 | | C; guessing termini instead |
| 5075 | | No usable SEQRES records for ylODC_54bpOriC061_rev30_PostPhenix.pdb (#2) chain |
| 5076 | | D; guessing termini instead |
| 5077 | | No usable SEQRES records for ylODC_54bpOriC061_rev30_PostPhenix.pdb (#2) chain |
| 5078 | | E; guessing termini instead |
| 5079 | | No usable SEQRES records for ylODC_54bpOriC061_rev30_PostPhenix.pdb (#2) chain |
| 5080 | | F; guessing termini instead |
| 5081 | | No usable SEQRES records for ylODC_54bpOriC061_rev30_PostPhenix.pdb (#2) chain |
| 5082 | | G; guessing termini instead |
| 5083 | | Termini for ylODC_54bpOriC061_rev30_PostPhenix.pdb (#2) chain H determined |
| 5084 | | from SEQRES records |
| 5085 | | Termini for ylODC_54bpOriC061_rev30_PostPhenix.pdb (#2) chain I determined |
| 5086 | | from SEQRES records |
| 5087 | | Chain-initial residues that are actual N termini: |
| 5088 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/A PRO 299, |
| 5089 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/B PRO 106, |
| 5090 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/C THR 6, |
| 5091 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/D VAL 34, |
| 5092 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/E MET 1, |
| 5093 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/F PRO 179, |
| 5094 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/G PRO 93, |
| 5095 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/C THR 6, |
| 5096 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/C ASN 72, |
| 5097 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/D VAL 34, |
| 5098 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/D GLN 127, |
| 5099 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/D LEU 296, |
| 5100 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/D PHE 436, |
| 5101 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/E MET 1, |
| 5102 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/E ASP 319, |
| 5103 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/F PRO 179, |
| 5104 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/F GLY 316, |
| 5105 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/G PRO 93, |
| 5106 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/G ALA 213, |
| 5107 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/G THR 386, |
| 5108 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/G VAL 439 |
| 5109 | | Chain-initial residues that are not actual N termini: |
| 5110 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/C ASN 72, |
| 5111 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/D GLN 127, |
| 5112 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/D LEU 296, |
| 5113 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/D PHE 436, |
| 5114 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/E ASP 319, |
| 5115 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/F GLY 316, |
| 5116 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/G ALA 213, |
| 5117 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/G THR 386, |
| 5118 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/G VAL 439 |
| 5119 | | Chain-final residues that are actual C termini: |
| 5120 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/A LEU 718, |
| 5121 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/B LEU 507, |
| 5122 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/C LEU 685, |
| 5123 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/D ARG 511, |
| 5124 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/C ARG 29, |
| 5125 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/C LEU 685, |
| 5126 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/D SER 123, |
| 5127 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/D MET 285, |
| 5128 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/D LEU 420, |
| 5129 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/D ARG 511, |
| 5130 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/E MET 300, |
| 5131 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/E ASN 464, |
| 5132 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/F THR 307, |
| 5133 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/F LYS 349, |
| 5134 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/G GLY 207, |
| 5135 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/G HIS 335, |
| 5136 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/G ASN 434, |
| 5137 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/G LYS 602 |
| 5138 | | Chain-final residues that are not actual C termini: |
| 5139 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/C ARG 29, |
| 5140 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/D SER 123, |
| 5141 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/D MET 285, |
| 5142 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/D LEU 420, |
| 5143 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/E ASN 464, |
| 5144 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/E MET 300, |
| 5145 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/F LYS 349, |
| 5146 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/F THR 307, |
| 5147 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/G LYS 602, |
| 5148 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/G GLY 207, |
| 5149 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/G HIS 335, |
| 5150 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/G ASN 434 |
| 5151 | | Chain-initial residues that are not actual 5' termini: |
| 5152 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/I DG 13 |
| 5153 | | Missing OXT added to C-terminal residue ylODC_54bpOriC061_rev30_PostPhenix.pdb |
| 5154 | | #2/B LEU 507 |
| 5155 | | Missing OXT added to C-terminal residue ylODC_54bpOriC061_rev30_PostPhenix.pdb |
| 5156 | | #2/C ARG 29 |
| 5157 | | Missing OXT added to C-terminal residue ylODC_54bpOriC061_rev30_PostPhenix.pdb |
| 5158 | | #2/D SER 123 |
| 5159 | | Missing OXT added to C-terminal residue ylODC_54bpOriC061_rev30_PostPhenix.pdb |
| 5160 | | #2/D MET 285 |
| 5161 | | Missing OXT added to C-terminal residue ylODC_54bpOriC061_rev30_PostPhenix.pdb |
| 5162 | | #2/D LEU 420 |
| 5163 | | 8 messages similar to the above omitted |
| 5164 | | 3052 hydrogen bonds |
| 5165 | | Adding 'H' to ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/C ASN 72 |
| 5166 | | Adding 'H' to ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/D GLN 127 |
| 5167 | | Adding 'H' to ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/D LEU 296 |
| 5168 | | Adding 'H' to ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/D PHE 436 |
| 5169 | | Adding 'H' to ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/E ASP 319 |
| 5170 | | 4 messages similar to the above omitted |
| 5171 | | 24712 hydrogens added |
| 5172 | | |
| 5173 | | |
| 5174 | | > select #1/D:465@CE |
| 5175 | | |
| 5176 | | 1 atom, 1 residue, 1 model selected |
| 5177 | | |
| 5178 | | > ui tool show "Add Hydrogens" |
| 5179 | | |
| 5180 | | > addh #!1 |
| 5181 | | |
| 5182 | | Summary of feedback from adding hydrogens to |
| 5183 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1 |
| 5184 | | --- |
| 5185 | | warnings | Not adding hydrogens to ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/H DG 8 P because it is missing heavy-atom bond partners |
| 5186 | | Not adding hydrogens to ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/I DG 13 P |
| 5187 | | because it is missing heavy-atom bond partners |
| 5188 | | notes | Termini for ylODC_54bpOriC061_rev29_PostPhenix.pdb (#1) chain A determined from SEQRES records |
| 5189 | | Termini for ylODC_54bpOriC061_rev29_PostPhenix.pdb (#1) chain B determined |
| 5190 | | from SEQRES records |
| 5191 | | No usable SEQRES records for ylODC_54bpOriC061_rev29_PostPhenix.pdb (#1) chain |
| 5192 | | C; guessing termini instead |
| 5193 | | No usable SEQRES records for ylODC_54bpOriC061_rev29_PostPhenix.pdb (#1) chain |
| 5194 | | D; guessing termini instead |
| 5195 | | No usable SEQRES records for ylODC_54bpOriC061_rev29_PostPhenix.pdb (#1) chain |
| 5196 | | E; guessing termini instead |
| 5197 | | No usable SEQRES records for ylODC_54bpOriC061_rev29_PostPhenix.pdb (#1) chain |
| 5198 | | F; guessing termini instead |
| 5199 | | No usable SEQRES records for ylODC_54bpOriC061_rev29_PostPhenix.pdb (#1) chain |
| 5200 | | G; guessing termini instead |
| 5201 | | Termini for ylODC_54bpOriC061_rev29_PostPhenix.pdb (#1) chain H determined |
| 5202 | | from SEQRES records |
| 5203 | | Termini for ylODC_54bpOriC061_rev29_PostPhenix.pdb (#1) chain I determined |
| 5204 | | from SEQRES records |
| 5205 | | Chain-initial residues that are actual N termini: |
| 5206 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/A PRO 299, |
| 5207 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/B PRO 106, |
| 5208 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/C THR 6, |
| 5209 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/D VAL 34, |
| 5210 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/E MET 1, |
| 5211 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/F PRO 179, |
| 5212 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/G PRO 93, |
| 5213 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/C THR 6, |
| 5214 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/C ASN 72, |
| 5215 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/D VAL 34, |
| 5216 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/D GLN 127, |
| 5217 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/D LEU 296, |
| 5218 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/D PHE 436, |
| 5219 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/E MET 1, |
| 5220 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/E ASP 319, |
| 5221 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/F PRO 179, |
| 5222 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/F GLY 316, |
| 5223 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/G PRO 93, |
| 5224 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/G ALA 213, |
| 5225 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/G THR 386, |
| 5226 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/G VAL 439 |
| 5227 | | Chain-initial residues that are not actual N termini: |
| 5228 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/C ASN 72, |
| 5229 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/D GLN 127, |
| 5230 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/D LEU 296, |
| 5231 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/D PHE 436, |
| 5232 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/E ASP 319, |
| 5233 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/F GLY 316, |
| 5234 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/G ALA 213, |
| 5235 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/G THR 386, |
| 5236 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/G VAL 439 |
| 5237 | | Chain-final residues that are actual C termini: |
| 5238 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/A LEU 718, |
| 5239 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/B LEU 507, |
| 5240 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/C LEU 685, |
| 5241 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/D ARG 511, |
| 5242 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/C ARG 29, |
| 5243 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/C LEU 685, |
| 5244 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/D SER 123, |
| 5245 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/D MET 285, |
| 5246 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/D LEU 420, |
| 5247 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/D ARG 511, |
| 5248 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/E MET 300, |
| 5249 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/E ASN 464, |
| 5250 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/F THR 307, |
| 5251 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/F LYS 349, |
| 5252 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/G GLY 207, |
| 5253 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/G HIS 335, |
| 5254 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/G ASN 434, |
| 5255 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/G LYS 602 |
| 5256 | | Chain-final residues that are not actual C termini: |
| 5257 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/C ARG 29, |
| 5258 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/D SER 123, |
| 5259 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/D MET 285, |
| 5260 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/D LEU 420, |
| 5261 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/E ASN 464, |
| 5262 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/E MET 300, |
| 5263 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/F LYS 349, |
| 5264 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/F THR 307, |
| 5265 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/G LYS 602, |
| 5266 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/G GLY 207, |
| 5267 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/G HIS 335, |
| 5268 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/G ASN 434 |
| 5269 | | Chain-initial residues that are not actual 5' termini: |
| 5270 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/I DG 13 |
| 5271 | | Missing OXT added to C-terminal residue ylODC_54bpOriC061_rev29_PostPhenix.pdb |
| 5272 | | #1/B LEU 507 |
| 5273 | | Missing OXT added to C-terminal residue ylODC_54bpOriC061_rev29_PostPhenix.pdb |
| 5274 | | #1/C ARG 29 |
| 5275 | | Missing OXT added to C-terminal residue ylODC_54bpOriC061_rev29_PostPhenix.pdb |
| 5276 | | #1/D SER 123 |
| 5277 | | Missing OXT added to C-terminal residue ylODC_54bpOriC061_rev29_PostPhenix.pdb |
| 5278 | | #1/D MET 285 |
| 5279 | | Missing OXT added to C-terminal residue ylODC_54bpOriC061_rev29_PostPhenix.pdb |
| 5280 | | #1/D LEU 420 |
| 5281 | | 8 messages similar to the above omitted |
| 5282 | | 3042 hydrogen bonds |
| 5283 | | Adding 'H' to ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/C ASN 72 |
| 5284 | | Adding 'H' to ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/D GLN 127 |
| 5285 | | Adding 'H' to ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/D LEU 296 |
| 5286 | | Adding 'H' to ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/D PHE 436 |
| 5287 | | Adding 'H' to ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/E ASP 319 |
| 5288 | | 4 messages similar to the above omitted |
| 5289 | | 24712 hydrogens added |
| 5290 | | |
| 5291 | | |
| 5292 | | > ui tool show H-Bonds |
| 5293 | | |
| 5294 | | > select #1/D:465 |
| 5295 | | |
| 5296 | | 22 atoms, 21 bonds, 1 residue, 1 model selected |
| 5297 | | |
| 5298 | | > hbonds sel restrict #1/H,I twoColors true intraRes false reveal true log |
| 5299 | | > true |
| 5300 | | |
| 5301 | | |
| 5302 | | Finding intermodel H-bonds |
| 5303 | | Finding intramodel H-bonds |
| 5304 | | Constraints relaxed by 0.4 angstroms and 20 degrees |
| 5305 | | Models used: |
| 5306 | | 1 ylODC_54bpOriC061_rev29_PostPhenix.pdb |
| 5307 | | |
| 5308 | | 2 H-bonds |
| 5309 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 5310 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/D LYS 465 NZ ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/I DG 31 O6 ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/D LYS 465 HZ1 2.845 1.875 |
| 5311 | | ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/D LYS 465 NZ ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/I DG 32 N7 ylODC_54bpOriC061_rev29_PostPhenix.pdb #1/D LYS 465 HZ2 3.459 2.599 |
| 5312 | | |
| 5313 | | |
| 5314 | | |
| 5315 | | 2 hydrogen bonds found |
| 5316 | | 0 strict hydrogen bonds found |
| 5317 | | |
| 5318 | | > select #2/D:465 |
| 5319 | | |
| 5320 | | 22 atoms, 21 bonds, 1 residue, 1 model selected |
| 5321 | | |
| 5322 | | > ui tool show H-Bonds |
| 5323 | | |
| 5324 | | > hbonds sel restrict #2/H,I twoColors true intraRes false reveal true log |
| 5325 | | > true |
| 5326 | | |
| 5327 | | |
| 5328 | | Finding intermodel H-bonds |
| 5329 | | Finding intramodel H-bonds |
| 5330 | | Constraints relaxed by 0.4 angstroms and 20 degrees |
| 5331 | | Models used: |
| 5332 | | 2 ylODC_54bpOriC061_rev30_PostPhenix.pdb |
| 5333 | | |
| 5334 | | 2 H-bonds |
| 5335 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 5336 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/D LYS 465 NZ ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/I DG 31 O6 ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/D LYS 465 HZ1 2.363 1.498 |
| 5337 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/D LYS 465 NZ ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/I DG 32 O6 ylODC_54bpOriC061_rev30_PostPhenix.pdb #2/D LYS 465 HZ2 2.546 1.684 |
| 5338 | | |
| 5339 | | |
| 5340 | | |
| 5341 | | 2 hydrogen bonds found |
| 5342 | | 0 strict hydrogen bonds found |
| 5343 | | |
| 5344 | | > ui tool show "Side View" |
| 5345 | | |
| 5346 | | > close #2 |
| 5347 | | |
| 5348 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 5349 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 5350 | | > structures/PDBs/ylODC_54bp- |
| 5351 | | > oriC061_complete/ylODC_54bpOriC061_rev30_PostPhenix.pdb" format pdb |
| 5352 | | |
| 5353 | | Chain information for ylODC_54bpOriC061_rev30_PostPhenix.pdb #2 |
| 5354 | | --- |
| 5355 | | Chain | Description |
| 5356 | | A | No description available |
| 5357 | | B | No description available |
| 5358 | | C | No description available |
| 5359 | | D | No description available |
| 5360 | | E | No description available |
| 5361 | | F | No description available |
| 5362 | | G | No description available |
| 5363 | | H | No description available |
| 5364 | | I | No description available |
| 5365 | | |
| 5366 | | |
| 5367 | | > modelfix |
| 5368 | | |
| 5369 | | Changed 75323 atom styles |
| 5370 | | 71260 atoms, 72152 bonds, 18 pseudobonds, 5940 residues, 4 models selected |
| 5371 | | |
| 5372 | | > close #1 |
| 5373 | | |
| 5374 | | > select /A,B,C,E,F |
| 5375 | | |
| 5376 | | 16637 atoms, 16971 bonds, 4 pseudobonds, 2073 residues, 3 models selected |
| 5377 | | |
| 5378 | | > hide sel cartoons |
| 5379 | | |
| 5380 | | > select clear |
| 5381 | | |
| 5382 | | > select ~nucleic |
| 5383 | | |
| 5384 | | 23823 atoms, 24273 bonds, 11 pseudobonds, 2978 residues, 3 models selected |
| 5385 | | |
| 5386 | | > hide sel atoms |
| 5387 | | |
| 5388 | | > select clear |
| 5389 | | |
| 5390 | | > select /D:465 |
| 5391 | | |
| 5392 | | 9 atoms, 8 bonds, 1 residue, 1 model selected |
| 5393 | | |
| 5394 | | > show sel atoms |
| 5395 | | |
| 5396 | | > select /G:548 |
| 5397 | | |
| 5398 | | 9 atoms, 8 bonds, 1 residue, 1 model selected |
| 5399 | | |
| 5400 | | > show sel atoms |
| 5401 | | |
| 5402 | | > select /G:557 |
| 5403 | | |
| 5404 | | 11 atoms, 10 bonds, 1 residue, 1 model selected |
| 5405 | | |
| 5406 | | > show sel atoms |
| 5407 | | |
| 5408 | | > select clear |
| 5409 | | |
| 5410 | | > save "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 5411 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/figures for |
| 5412 | | > posterpub/Orc4-Cdc6-element-54bpOriC061-ver1.png" supersample 3 |
| 5413 | | |
| 5414 | | > select clear |
| 5415 | | |
| 5416 | | > select /A,B,C,E,F |
| 5417 | | |
| 5418 | | 16637 atoms, 16971 bonds, 4 pseudobonds, 2073 residues, 3 models selected |
| 5419 | | |
| 5420 | | > show sel atoms |
| 5421 | | |
| 5422 | | > undo |
| 5423 | | |
| 5424 | | > show sel cartoons |
| 5425 | | |
| 5426 | | > color sel #808080 |
| 5427 | | |
| 5428 | | > color sel #AAAAAA |
| 5429 | | |
| 5430 | | > color sel #BBBBBB |
| 5431 | | |
| 5432 | | > transparency 70 r |
| 5433 | | |
| 5434 | | Expected a collection of one of 'All', 'atoms', 'bonds', 'cartoons', 'labels', |
| 5435 | | 'models', 'pseudobonds', 'ribbons', 'rings', or 'surfaces' or a keyword |
| 5436 | | |
| 5437 | | > transparency 70 cartoons |
| 5438 | | |
| 5439 | | > select clear |
| 5440 | | |
| 5441 | | > undo |
| 5442 | | |
| 5443 | | > transparency 0 ribbons |
| 5444 | | |
| 5445 | | > transparency 0 r |
| 5446 | | |
| 5447 | | Expected a collection of one of 'All', 'atoms', 'bonds', 'cartoons', 'labels', |
| 5448 | | 'models', 'pseudobonds', 'ribbons', 'rings', or 'surfaces' or a keyword |
| 5449 | | |
| 5450 | | > transparency 0 sel |
| 5451 | | |
| 5452 | | Expected a collection of one of 'All', 'atoms', 'bonds', 'cartoons', 'labels', |
| 5453 | | 'models', 'pseudobonds', 'ribbons', 'rings', or 'surfaces' or a keyword |
| 5454 | | |
| 5455 | | > transparency sel 70 target c |
| 5456 | | |
| 5457 | | > transparency sel 90 target c |
| 5458 | | |
| 5459 | | > transparency sel 80 target c |
| 5460 | | |
| 5461 | | > transparency sel 75 target c |
| 5462 | | |
| 5463 | | > select clear |
| 5464 | | |
| 5465 | | > select /A,B,C,E,F |
| 5466 | | |
| 5467 | | 16637 atoms, 16971 bonds, 4 pseudobonds, 2073 residues, 3 models selected |
| 5468 | | |
| 5469 | | > hide sel cartoons |
| 5470 | | |
| 5471 | | > show sel cartoons |
| 5472 | | |
| 5473 | | > select clear |
| 5474 | | |
| 5475 | | > turn x 2 180 |
| 5476 | | |
| 5477 | | > wait 180 |
| 5478 | | |
| 5479 | | > turn y 2 180 |
| 5480 | | |
| 5481 | | > wait 180 |
| 5482 | | |
| 5483 | | > turn y 2 180 |
| 5484 | | |
| 5485 | | > wait 180 |
| 5486 | | |
| 5487 | | > select /A,B,C,E,F |
| 5488 | | |
| 5489 | | 16637 atoms, 16971 bonds, 4 pseudobonds, 2073 residues, 3 models selected |
| 5490 | | |
| 5491 | | > hide sel cartoons |
| 5492 | | |
| 5493 | | > select up |
| 5494 | | |
| 5495 | | 25299 atoms, 25927 bonds, 11 pseudobonds, 3050 residues, 3 models selected |
| 5496 | | |
| 5497 | | > select up |
| 5498 | | |
| 5499 | | 25299 atoms, 25927 bonds, 11 pseudobonds, 3050 residues, 3 models selected |
| 5500 | | |
| 5501 | | > select clear |
| 5502 | | |
| 5503 | | > turn y 2 180 |
| 5504 | | |
| 5505 | | > wait 180 |
| 5506 | | |
| 5507 | | > turn y 2 180 |
| 5508 | | |
| 5509 | | > wait 180 |
| 5510 | | |
| 5511 | | > turn y 2 180 |
| 5512 | | |
| 5513 | | > wait 180 |
| 5514 | | |
| 5515 | | > turn y 2 180 |
| 5516 | | |
| 5517 | | > wait 180 |
| 5518 | | |
| 5519 | | > turn y 2 180 |
| 5520 | | |
| 5521 | | > wait 180 |
| 5522 | | |
| 5523 | | > select /I:32@O6 |
| 5524 | | |
| 5525 | | 1 atom, 1 residue, 1 model selected |
| 5526 | | |
| 5527 | | > turn y 2 180 centerOn sel ; wait 180 |
| 5528 | | |
| 5529 | | Expected a keyword |
| 5530 | | |
| 5531 | | > turn y 2 180 centerOn sel ; wait 180 |
| 5532 | | |
| 5533 | | Expected a keyword |
| 5534 | | |
| 5535 | | > turn y 2 180 center sel |
| 5536 | | |
| 5537 | | > wait 180 |
| 5538 | | |
| 5539 | | > select clear |
| 5540 | | |
| 5541 | | > turn y 2 180 center sel ; wait 180 |
| 5542 | | |
| 5543 | | Invalid "center" argument: Center argument no objects specified |
| 5544 | | |
| 5545 | | > select /I:31@O6 |
| 5546 | | |
| 5547 | | 1 atom, 1 residue, 1 model selected |
| 5548 | | |
| 5549 | | > turn y 2 180 center sel |
| 5550 | | |
| 5551 | | > wait 180 |
| 5552 | | |
| 5553 | | > turn y 2 180 center (#1/I:31 | #1/H:24) ; wait 180 |
| 5554 | | |
| 5555 | | Invalid "center" argument: Center argument no objects specified |
| 5556 | | |
| 5557 | | > select clear |
| 5558 | | |
| 5559 | | > turn y 2 180 center (#1/I:31 | #1/H:24) ; wait 180 |
| 5560 | | |
| 5561 | | Invalid "center" argument: Center argument no objects specified |
| 5562 | | |
| 5563 | | > turn y 2 180 center #1/I:31 ; wait 180 |
| 5564 | | |
| 5565 | | Invalid "center" argument: Center argument no objects specified |
| 5566 | | |
| 5567 | | > turn y 2 180 models #1/I:31 |
| 5568 | | |
| 5569 | | > wait 180 |
| 5570 | | |
| 5571 | | > turn y 2 180 models #1/I:31 |
| 5572 | | |
| 5573 | | > wait 180 |
| 5574 | | |
| 5575 | | > turn y 2 180 models #1/I:31 |
| 5576 | | |
| 5577 | | > turn y 2 180 models #1 center #1/I:31 |
| 5578 | | |
| 5579 | | Invalid "center" argument: Center argument no objects specified |
| 5580 | | |
| 5581 | | > select clear |
| 5582 | | |
| 5583 | | > select /I:31@O6 |
| 5584 | | |
| 5585 | | 1 atom, 1 residue, 1 model selected |
| 5586 | | |
| 5587 | | > select clear |
| 5588 | | |
| 5589 | | > turn y 2 180 models #1 center #1/I:31@O6 |
| 5590 | | |
| 5591 | | Invalid "center" argument: Center argument no objects specified |
| 5592 | | |
| 5593 | | > turn y 2 180 center #1/I:31@O6 |
| 5594 | | |
| 5595 | | Invalid "center" argument: Center argument no objects specified |
| 5596 | | |
| 5597 | | > select /I:31@O6 |
| 5598 | | |
| 5599 | | 1 atom, 1 residue, 1 model selected |
| 5600 | | |
| 5601 | | > turn y 2 180 center /I:31@O6 |
| 5602 | | |
| 5603 | | > select clear |
| 5604 | | |
| 5605 | | > turn y 2 180 center /I:31@O6 |
| 5606 | | |
| 5607 | | > turn y 1 360 center /I:31@O6 |
| 5608 | | |
| 5609 | | > wait 360 |
| 5610 | | |
| 5611 | | > turn y 1 360 center /I:31@O6 |
| 5612 | | |
| 5613 | | > wait 360 |
| 5614 | | |
| 5615 | | > movie record supersample 3 |
| 5616 | | |
| 5617 | | > turn y 2 180 center /I:31@O6 |
| 5618 | | |
| 5619 | | > wait 180 |
| 5620 | | |
| 5621 | | > movie encode "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 5622 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/figures for |
| 5623 | | > posterpub/Orc4-Cdc6-binding-region-54bpOriC.mp4" |
| 5624 | | |
| 5625 | | Movie saved to /Users/jtbauer/.../figures for posterpub/Orc4-Cdc6-binding- |
| 5626 | | region-54bpOriC.mp4 |
| 5627 | | |
| 5628 | | |
| 5629 | | > turn y 2 180 center /I:31@O6 |
| 5630 | | |
| 5631 | | > wait 180 |
| 5632 | | |
| 5633 | | > turn y 2 180 center /I:31@O6 |
| 5634 | | |
| 5635 | | > wait 180 |
| 5636 | | |
| 5637 | | > turn y 2 180 center /I:31@O6 |
| 5638 | | |
| 5639 | | > wait 180 |
| 5640 | | |
| 5641 | | > turn y 2 180 center /I:31@O6 |
| 5642 | | |
| 5643 | | > wait 180 |
| 5644 | | |
| 5645 | | > turn y 2 180 center /I:31@O6 |
| 5646 | | |
| 5647 | | > wait 180 |
| 5648 | | |
| 5649 | | > turn y 2 180 center /I:31@O6 |
| 5650 | | |
| 5651 | | > wait 180 |
| 5652 | | |
| 5653 | | > turn y 2 180 center /I:31@O6 |
| 5654 | | |
| 5655 | | > wait 180 |
| 5656 | | |
| 5657 | | > turn y 2 180 center /I:31@O6 |
| 5658 | | |
| 5659 | | > wait 180 |
| 5660 | | |
| 5661 | | > turn y 2 180 center /I:31@O6 |
| 5662 | | |
| 5663 | | > wait 180 |
| 5664 | | |
| 5665 | | > movie record supersample 3 |
| 5666 | | |
| 5667 | | > turn y 2 180 center /I:31@O6 |
| 5668 | | |
| 5669 | | > wait 180 |
| 5670 | | |
| 5671 | | > movie encode "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 5672 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/figures for |
| 5673 | | > posterpub/Orc4-Cdc6-binding-region-54bpOriC-camera2.mp4" |
| 5674 | | |
| 5675 | | Movie saved to /Users/jtbauer/.../figures for posterpub/Orc4-Cdc6-binding- |
| 5676 | | region-54bpOriC-camera2.mp4 |
| 5677 | | |
| 5678 | | |
| 5679 | | > show cartoons |
| 5680 | | |
| 5681 | | > transparency 0 cartoons |
| 5682 | | |
| 5683 | | > modelfix |
| 5684 | | |
| 5685 | | Changed 25299 atom styles |
| 5686 | | 23699 atoms, 24145 bonds, 9 pseudobonds, 2970 residues, 2 models selected |
| 5687 | | |
| 5688 | | > select nucleic |
| 5689 | | |
| 5690 | | 1476 atoms, 1654 bonds, 72 residues, 1 model selected |
| 5691 | | |
| 5692 | | > ui tool show "Add Hydrogens" |
| 5693 | | |
| 5694 | | > addh #!2 |
| 5695 | | |
| 5696 | | Summary of feedback from adding hydrogens to |
| 5697 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #2 |
| 5698 | | --- |
| 5699 | | warnings | Not adding hydrogens to /H DG 8 P because it is missing heavy-atom bond partners |
| 5700 | | Not adding hydrogens to /I DG 13 P because it is missing heavy-atom bond |
| 5701 | | partners |
| 5702 | | notes | Termini for ylODC_54bpOriC061_rev30_PostPhenix.pdb (#2) chain A determined from SEQRES records |
| 5703 | | Termini for ylODC_54bpOriC061_rev30_PostPhenix.pdb (#2) chain B determined |
| 5704 | | from SEQRES records |
| 5705 | | No usable SEQRES records for ylODC_54bpOriC061_rev30_PostPhenix.pdb (#2) chain |
| 5706 | | C; guessing termini instead |
| 5707 | | No usable SEQRES records for ylODC_54bpOriC061_rev30_PostPhenix.pdb (#2) chain |
| 5708 | | D; guessing termini instead |
| 5709 | | No usable SEQRES records for ylODC_54bpOriC061_rev30_PostPhenix.pdb (#2) chain |
| 5710 | | E; guessing termini instead |
| 5711 | | No usable SEQRES records for ylODC_54bpOriC061_rev30_PostPhenix.pdb (#2) chain |
| 5712 | | F; guessing termini instead |
| 5713 | | No usable SEQRES records for ylODC_54bpOriC061_rev30_PostPhenix.pdb (#2) chain |
| 5714 | | G; guessing termini instead |
| 5715 | | Termini for ylODC_54bpOriC061_rev30_PostPhenix.pdb (#2) chain H determined |
| 5716 | | from SEQRES records |
| 5717 | | Termini for ylODC_54bpOriC061_rev30_PostPhenix.pdb (#2) chain I determined |
| 5718 | | from SEQRES records |
| 5719 | | Chain-initial residues that are actual N termini: /A PRO 299, /B PRO 106, /C |
| 5720 | | THR 6, /D VAL 34, /E MET 1, /F PRO 179, /G PRO 93, /C THR 6, /C ASN 72, /D VAL |
| 5721 | | 34, /D GLN 127, /D LEU 296, /D PHE 436, /E MET 1, /E ASP 319, /F PRO 179, /F |
| 5722 | | GLY 316, /G PRO 93, /G ALA 213, /G THR 386, /G VAL 439 |
| 5723 | | Chain-initial residues that are not actual N termini: /C ASN 72, /D GLN 127, |
| 5724 | | /D LEU 296, /D PHE 436, /E ASP 319, /F GLY 316, /G ALA 213, /G THR 386, /G VAL |
| 5725 | | 439 |
| 5726 | | Chain-final residues that are actual C termini: /A LEU 718, /B LEU 507, /C LEU |
| 5727 | | 685, /D ARG 511, /C ARG 29, /C LEU 685, /D SER 123, /D MET 285, /D LEU 420, /D |
| 5728 | | ARG 511, /E MET 300, /E ASN 464, /F THR 307, /F LYS 349, /G GLY 207, /G HIS |
| 5729 | | 335, /G ASN 434, /G LYS 602 |
| 5730 | | Chain-final residues that are not actual C termini: /C ARG 29, /D SER 123, /D |
| 5731 | | MET 285, /D LEU 420, /E ASN 464, /E MET 300, /F LYS 349, /F THR 307, /G LYS |
| 5732 | | 602, /G GLY 207, /G HIS 335, /G ASN 434 |
| 5733 | | Chain-initial residues that are not actual 5' termini: /I DG 13 |
| 5734 | | Missing OXT added to C-terminal residue /B LEU 507 |
| 5735 | | Missing OXT added to C-terminal residue /C ARG 29 |
| 5736 | | Missing OXT added to C-terminal residue /D SER 123 |
| 5737 | | Missing OXT added to C-terminal residue /D MET 285 |
| 5738 | | Missing OXT added to C-terminal residue /D LEU 420 |
| 5739 | | 8 messages similar to the above omitted |
| 5740 | | 3052 hydrogen bonds |
| 5741 | | Adding 'H' to /C ASN 72 |
| 5742 | | Adding 'H' to /D GLN 127 |
| 5743 | | Adding 'H' to /D LEU 296 |
| 5744 | | Adding 'H' to /D PHE 436 |
| 5745 | | Adding 'H' to /E ASP 319 |
| 5746 | | 4 messages similar to the above omitted |
| 5747 | | 24712 hydrogens added |
| 5748 | | |
| 5749 | | |
| 5750 | | > ui tool show H-Bonds |
| 5751 | | |
| 5752 | | > hbonds sel restrict #2/A,B,C,D,E,F,G twoColors true intraRes false reveal |
| 5753 | | > true log true |
| 5754 | | |
| 5755 | | |
| 5756 | | Finding intermodel H-bonds |
| 5757 | | Finding intramodel H-bonds |
| 5758 | | Constraints relaxed by 0.4 angstroms and 20 degrees |
| 5759 | | Models used: |
| 5760 | | 2 ylODC_54bpOriC061_rev30_PostPhenix.pdb |
| 5761 | | |
| 5762 | | 61 H-bonds |
| 5763 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 5764 | | /A ARG 301 NE /I DC 47 OP1 /A ARG 301 HE 3.042 2.096 |
| 5765 | | /A ARG 301 NH1 /H DT 10 O2 /A ARG 301 HH12 2.780 1.937 |
| 5766 | | /A ARG 301 NH1 /H DC 11 O4' /A ARG 301 HH11 2.808 1.918 |
| 5767 | | /A ARG 301 NH2 /I DT 46 O2 /A ARG 301 HH22 3.419 2.726 |
| 5768 | | /A ARG 301 NH2 /I DC 47 OP1 /A ARG 301 HH21 3.241 2.383 |
| 5769 | | /A PHE 303 N /H DC 13 OP1 /A PHE 303 H 2.683 1.713 |
| 5770 | | /A LYS 305 NZ /H DA 14 OP1 /A LYS 305 HZ1 3.005 2.074 |
| 5771 | | /A ASN 435 ND2 /H DC 13 OP2 /A ASN 435 HD22 2.896 1.911 |
| 5772 | | /A ASN 436 ND2 /H DC 13 OP2 /A ASN 436 HD22 3.172 2.251 |
| 5773 | | /B LYS 148 NZ /I DG 19 OP1 /B LYS 148 HZ3 2.880 2.062 |
| 5774 | | /B ARG 150 NH1 /H DG 35 O6 /B ARG 150 HH12 3.317 2.492 |
| 5775 | | /B ARG 150 NH1 /I DG 19 O6 /B ARG 150 HH12 3.200 2.518 |
| 5776 | | /B ARG 150 NH2 /H DG 35 O6 /B ARG 150 HH22 2.932 1.954 |
| 5777 | | /B GLY 153 N /H DT 34 OP2 /B GLY 153 H 2.955 1.965 |
| 5778 | | /B LYS 248 NZ /I DA 37 O3' /B LYS 248 HZ1 3.058 2.307 |
| 5779 | | /B LYS 279 N /I DA 39 OP1 /B LYS 279 H 3.012 2.176 |
| 5780 | | /B ASP 280 N /I DA 39 OP1 /B ASP 280 H 3.419 2.439 |
| 5781 | | /C LYS 188 NZ /H DT 18 OP1 /C LYS 188 HZ1 2.597 1.602 |
| 5782 | | /C ARG 219 N /I DT 41 OP1 /C ARG 219 H 2.860 1.859 |
| 5783 | | /C ARG 219 NH1 /I DT 40 OP1 /C ARG 219 HH11 2.808 2.044 |
| 5784 | | /C ARG 220 NH1 /H DT 16 O2 /C ARG 220 HH11 3.328 2.600 |
| 5785 | | /C ARG 220 NH1 /I DT 40 O2 /C ARG 220 HH11 3.062 2.380 |
| 5786 | | /C TYR 223 OH /H DA 17 O3' /C TYR 223 HH 2.926 2.064 |
| 5787 | | /C TYR 607 OH /H DC 32 OP2 /C TYR 607 HH 3.278 2.327 |
| 5788 | | /C ARG 672 N /H DC 32 OP1 /C ARG 672 H 2.895 1.905 |
| 5789 | | /C ARG 672 NH1 /I DT 25 O2 /C ARG 672 HH12 2.707 1.845 |
| 5790 | | /C ARG 672 NH2 /I DT 25 O2 /C ARG 672 HH22 3.408 2.771 |
| 5791 | | /C LYS 673 NZ /H DA 33 OP1 /C LYS 673 HZ1 2.886 1.972 |
| 5792 | | /D LYS 168 NZ /H DA 14 N3 /D LYS 168 HZ1 2.838 1.847 |
| 5793 | | /D SER 169 OG /H DA 15 OP2 /D SER 169 HG 2.801 1.842 |
| 5794 | | /D ILE 170 N /H DA 15 OP2 /D ILE 170 H 3.077 2.202 |
| 5795 | | /D SER 463 OG /I DG 30 OP1 /D SER 463 HG 2.493 1.565 |
| 5796 | | /D LYS 465 NZ /I DG 31 O6 /D LYS 465 HZ1 2.363 1.498 |
| 5797 | | /D LYS 465 NZ /I DG 32 O6 /D LYS 465 HZ2 2.546 1.684 |
| 5798 | | /E ARG 76 NH1 /H DA 17 OP1 /E ARG 76 HH11 3.235 2.257 |
| 5799 | | /E ARG 340 NE /I DG 19 O5' /E ARG 340 HE 3.009 2.192 |
| 5800 | | /E ARG 340 NE /I DG 19 OP2 /E ARG 340 HE 2.873 1.974 |
| 5801 | | /E ARG 340 NH2 /I DG 19 OP2 /E ARG 340 HH21 3.300 2.551 |
| 5802 | | /E TYR 341 OH /I DC 20 OP1 /E TYR 341 HH 2.940 2.219 |
| 5803 | | /E ARG 357 NH1 /I DT 16 O2 /E ARG 357 HH12 2.784 1.882 |
| 5804 | | /E ARG 357 NH2 /I DT 16 O2 /E ARG 357 HH22 2.882 2.025 |
| 5805 | | /E ARG 357 NH2 /I DT 16 O4' /E ARG 357 HH22 3.135 2.386 |
| 5806 | | /E GLU 358 N /H DG 41 OP1 /E GLU 358 H 2.888 1.905 |
| 5807 | | /E THR 359 OG1 /I DG 19 OP1 /E THR 359 HG1 2.802 2.243 |
| 5808 | | /E ARG 362 N /I DG 19 O3' /E ARG 362 H 3.350 2.344 |
| 5809 | | /E ARG 362 NH1 /I DT 18 O2 /E ARG 362 HH12 2.975 2.081 |
| 5810 | | /E ARG 362 NH1 /I DG 19 O4' /E ARG 362 HH11 3.022 2.183 |
| 5811 | | /E ARG 362 NH2 /H DT 38 O2 /E ARG 362 HH22 2.881 2.130 |
| 5812 | | /E LYS 363 N /I DC 20 OP2 /E LYS 363 H 3.408 2.442 |
| 5813 | | /E LYS 363 NZ /I DA 21 OP1 /E LYS 363 HZ1 2.944 1.968 |
| 5814 | | /G GLY 546 N /H DA 27 OP1 /G GLY 546 H 2.915 2.028 |
| 5815 | | /G LYS 547 NZ /I DG 32 OP1 /G LYS 547 HZ1 2.552 1.558 |
| 5816 | | /G LYS 548 NZ /I DT 29 O2 /G LYS 548 HZ3 3.197 2.248 |
| 5817 | | /G ASN 553 N /I DG 32 OP2 /G ASN 553 H 2.957 2.079 |
| 5818 | | /G ARG 557 NH1 /I DG 34 O6 /G ARG 557 HH12 2.913 1.906 |
| 5819 | | /G ARG 557 NH2 /I DG 34 N7 /G ARG 557 HH22 2.372 1.443 |
| 5820 | | /G GLY 561 N /H DT 16 OP2 /G GLY 561 H 2.846 2.111 |
| 5821 | | /G THR 563 OG1 /H DT 16 OP1 /G THR 563 HG1 3.027 2.078 |
| 5822 | | /G ALA 565 N /H DA 17 OP2 /G ALA 565 H 2.576 1.574 |
| 5823 | | /G ARG 574 NH2 /I DG 32 OP1 /G ARG 574 HH21 3.076 2.128 |
| 5824 | | /G LYS 581 NZ /H DA 26 OP2 /G LYS 581 HZ1 3.143 2.140 |
| 5825 | | |
| 5826 | | |
| 5827 | | |
| 5828 | | 61 hydrogen bonds found |
| 5829 | | 21 strict hydrogen bonds found |
| 5830 | | |
| 5831 | | > split #2 |
| 5832 | | |
| 5833 | | Split ylODC_54bpOriC061_rev30_PostPhenix.pdb (#2) into 9 models |
| 5834 | | Chain information for ylODC_54bpOriC061_rev30_PostPhenix.pdb A #2.1 |
| 5835 | | --- |
| 5836 | | Chain | Description |
| 5837 | | A | No description available |
| 5838 | | |
| 5839 | | Chain information for ylODC_54bpOriC061_rev30_PostPhenix.pdb B #2.2 |
| 5840 | | --- |
| 5841 | | Chain | Description |
| 5842 | | B | No description available |
| 5843 | | |
| 5844 | | Chain information for ylODC_54bpOriC061_rev30_PostPhenix.pdb C #2.3 |
| 5845 | | --- |
| 5846 | | Chain | Description |
| 5847 | | C | No description available |
| 5848 | | |
| 5849 | | Chain information for ylODC_54bpOriC061_rev30_PostPhenix.pdb D #2.4 |
| 5850 | | --- |
| 5851 | | Chain | Description |
| 5852 | | D | No description available |
| 5853 | | |
| 5854 | | Chain information for ylODC_54bpOriC061_rev30_PostPhenix.pdb E #2.5 |
| 5855 | | --- |
| 5856 | | Chain | Description |
| 5857 | | E | No description available |
| 5858 | | |
| 5859 | | Chain information for ylODC_54bpOriC061_rev30_PostPhenix.pdb F #2.6 |
| 5860 | | --- |
| 5861 | | Chain | Description |
| 5862 | | F | No description available |
| 5863 | | |
| 5864 | | Chain information for ylODC_54bpOriC061_rev30_PostPhenix.pdb G #2.7 |
| 5865 | | --- |
| 5866 | | Chain | Description |
| 5867 | | G | No description available |
| 5868 | | |
| 5869 | | Chain information for ylODC_54bpOriC061_rev30_PostPhenix.pdb H #2.8 |
| 5870 | | --- |
| 5871 | | Chain | Description |
| 5872 | | H | No description available |
| 5873 | | |
| 5874 | | Chain information for ylODC_54bpOriC061_rev30_PostPhenix.pdb I #2.9 |
| 5875 | | --- |
| 5876 | | Chain | Description |
| 5877 | | I | No description available |
| 5878 | | |
| 5879 | | |
| 5880 | | > select add #2.8 |
| 5881 | | |
| 5882 | | 1170 atoms, 1262 bonds, 37 residues, 1 model selected |
| 5883 | | |
| 5884 | | > select add #2.9 |
| 5885 | | |
| 5886 | | 2291 atoms, 2469 bonds, 72 residues, 2 models selected |
| 5887 | | |
| 5888 | | > hbonds sel restrict #2/A,B,C,D,E,F,G twoColors true intraRes false reveal |
| 5889 | | > true log true |
| 5890 | | |
| 5891 | | |
| 5892 | | Finding intermodel H-bonds |
| 5893 | | Finding intramodel H-bonds |
| 5894 | | Constraints relaxed by 0.4 angstroms and 20 degrees |
| 5895 | | Models used: |
| 5896 | | 2.7 ylODC_54bpOriC061_rev30_PostPhenix.pdb G |
| 5897 | | 2.9 ylODC_54bpOriC061_rev30_PostPhenix.pdb I |
| 5898 | | 2.8 ylODC_54bpOriC061_rev30_PostPhenix.pdb H |
| 5899 | | 2.1 ylODC_54bpOriC061_rev30_PostPhenix.pdb A |
| 5900 | | 2.2 ylODC_54bpOriC061_rev30_PostPhenix.pdb B |
| 5901 | | 2.3 ylODC_54bpOriC061_rev30_PostPhenix.pdb C |
| 5902 | | 2.4 ylODC_54bpOriC061_rev30_PostPhenix.pdb D |
| 5903 | | 2.5 ylODC_54bpOriC061_rev30_PostPhenix.pdb E |
| 5904 | | 2.6 ylODC_54bpOriC061_rev30_PostPhenix.pdb F |
| 5905 | | |
| 5906 | | 0 H-bonds |
| 5907 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 5908 | | |
| 5909 | | |
| 5910 | | |
| 5911 | | 0 hydrogen bonds found |
| 5912 | | 0 strict hydrogen bonds found |
| 5913 | | |
| 5914 | | > close #2 |
| 5915 | | |
| 5916 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 5917 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 5918 | | > structures/PDBs/ylODC_54bp- |
| 5919 | | > oriC061_complete/ylODC_54bpOriC061_rev30_PostPhenix.pdb" format pdb |
| 5920 | | |
| 5921 | | Chain information for ylODC_54bpOriC061_rev30_PostPhenix.pdb #1 |
| 5922 | | --- |
| 5923 | | Chain | Description |
| 5924 | | A | No description available |
| 5925 | | B | No description available |
| 5926 | | C | No description available |
| 5927 | | D | No description available |
| 5928 | | E | No description available |
| 5929 | | F | No description available |
| 5930 | | G | No description available |
| 5931 | | H | No description available |
| 5932 | | I | No description available |
| 5933 | | |
| 5934 | | |
| 5935 | | > modelfix |
| 5936 | | |
| 5937 | | Changed 25299 atom styles |
| 5938 | | 23699 atoms, 24145 bonds, 9 pseudobonds, 2970 residues, 2 models selected |
| 5939 | | |
| 5940 | | > select nucleic |
| 5941 | | |
| 5942 | | 1476 atoms, 1654 bonds, 72 residues, 1 model selected |
| 5943 | | |
| 5944 | | > hbonds sel saveFile "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 5945 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 5946 | | > structures/PDBs/ylODC_54bp-oriC061_complete/hbond-generation2" restrict |
| 5947 | | > #2/A,B,C,D,E,F,G twoColors true intraRes false reveal true log true |
| 5948 | | |
| 5949 | | 'restrict' atom specifier selects no atoms |
| 5950 | | |
| 5951 | | > ui tool show "Add Hydrogens" |
| 5952 | | |
| 5953 | | > addh #!1 |
| 5954 | | |
| 5955 | | Summary of feedback from adding hydrogens to |
| 5956 | | ylODC_54bpOriC061_rev30_PostPhenix.pdb #1 |
| 5957 | | --- |
| 5958 | | warnings | Not adding hydrogens to /H DG 8 P because it is missing heavy-atom bond partners |
| 5959 | | Not adding hydrogens to /I DG 13 P because it is missing heavy-atom bond |
| 5960 | | partners |
| 5961 | | notes | Termini for ylODC_54bpOriC061_rev30_PostPhenix.pdb (#1) chain A determined from SEQRES records |
| 5962 | | Termini for ylODC_54bpOriC061_rev30_PostPhenix.pdb (#1) chain B determined |
| 5963 | | from SEQRES records |
| 5964 | | No usable SEQRES records for ylODC_54bpOriC061_rev30_PostPhenix.pdb (#1) chain |
| 5965 | | C; guessing termini instead |
| 5966 | | No usable SEQRES records for ylODC_54bpOriC061_rev30_PostPhenix.pdb (#1) chain |
| 5967 | | D; guessing termini instead |
| 5968 | | No usable SEQRES records for ylODC_54bpOriC061_rev30_PostPhenix.pdb (#1) chain |
| 5969 | | E; guessing termini instead |
| 5970 | | No usable SEQRES records for ylODC_54bpOriC061_rev30_PostPhenix.pdb (#1) chain |
| 5971 | | F; guessing termini instead |
| 5972 | | No usable SEQRES records for ylODC_54bpOriC061_rev30_PostPhenix.pdb (#1) chain |
| 5973 | | G; guessing termini instead |
| 5974 | | Termini for ylODC_54bpOriC061_rev30_PostPhenix.pdb (#1) chain H determined |
| 5975 | | from SEQRES records |
| 5976 | | Termini for ylODC_54bpOriC061_rev30_PostPhenix.pdb (#1) chain I determined |
| 5977 | | from SEQRES records |
| 5978 | | Chain-initial residues that are actual N termini: /A PRO 299, /B PRO 106, /C |
| 5979 | | THR 6, /D VAL 34, /E MET 1, /F PRO 179, /G PRO 93, /C THR 6, /C ASN 72, /D VAL |
| 5980 | | 34, /D GLN 127, /D LEU 296, /D PHE 436, /E MET 1, /E ASP 319, /F PRO 179, /F |
| 5981 | | GLY 316, /G PRO 93, /G ALA 213, /G THR 386, /G VAL 439 |
| 5982 | | Chain-initial residues that are not actual N termini: /C ASN 72, /D GLN 127, |
| 5983 | | /D LEU 296, /D PHE 436, /E ASP 319, /F GLY 316, /G ALA 213, /G THR 386, /G VAL |
| 5984 | | 439 |
| 5985 | | Chain-final residues that are actual C termini: /A LEU 718, /B LEU 507, /C LEU |
| 5986 | | 685, /D ARG 511, /C ARG 29, /C LEU 685, /D SER 123, /D MET 285, /D LEU 420, /D |
| 5987 | | ARG 511, /E MET 300, /E ASN 464, /F THR 307, /F LYS 349, /G GLY 207, /G HIS |
| 5988 | | 335, /G ASN 434, /G LYS 602 |
| 5989 | | Chain-final residues that are not actual C termini: /C ARG 29, /D SER 123, /D |
| 5990 | | MET 285, /D LEU 420, /E ASN 464, /E MET 300, /F LYS 349, /F THR 307, /G LYS |
| 5991 | | 602, /G GLY 207, /G HIS 335, /G ASN 434 |
| 5992 | | Chain-initial residues that are not actual 5' termini: /I DG 13 |
| 5993 | | Missing OXT added to C-terminal residue /B LEU 507 |
| 5994 | | Missing OXT added to C-terminal residue /C ARG 29 |
| 5995 | | Missing OXT added to C-terminal residue /D SER 123 |
| 5996 | | Missing OXT added to C-terminal residue /D MET 285 |
| 5997 | | Missing OXT added to C-terminal residue /D LEU 420 |
| 5998 | | 8 messages similar to the above omitted |
| 5999 | | 3052 hydrogen bonds |
| 6000 | | Adding 'H' to /C ASN 72 |
| 6001 | | Adding 'H' to /D GLN 127 |
| 6002 | | Adding 'H' to /D LEU 296 |
| 6003 | | Adding 'H' to /D PHE 436 |
| 6004 | | Adding 'H' to /E ASP 319 |
| 6005 | | 4 messages similar to the above omitted |
| 6006 | | 24712 hydrogens added |
| 6007 | | |
| 6008 | | |
| 6009 | | > hbonds sel saveFile "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 6010 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 6011 | | > structures/PDBs/ylODC_54bp-oriC061_complete/hbond-generation2" restrict |
| 6012 | | > #1/A,B,C,D,E,F,G twoColors true intraRes false reveal true log true |
| 6013 | | |
| 6014 | | |
| 6015 | | Finding intermodel H-bonds |
| 6016 | | Finding intramodel H-bonds |
| 6017 | | Constraints relaxed by 0.4 angstroms and 20 degrees |
| 6018 | | Models used: |
| 6019 | | 1 ylODC_54bpOriC061_rev30_PostPhenix.pdb |
| 6020 | | |
| 6021 | | 61 H-bonds |
| 6022 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 6023 | | /A ARG 301 NE /I DC 47 OP1 /A ARG 301 HE 3.042 2.096 |
| 6024 | | /A ARG 301 NH1 /H DT 10 O2 /A ARG 301 HH12 2.780 1.937 |
| 6025 | | /A ARG 301 NH1 /H DC 11 O4' /A ARG 301 HH11 2.808 1.918 |
| 6026 | | /A ARG 301 NH2 /I DT 46 O2 /A ARG 301 HH22 3.419 2.726 |
| 6027 | | /A ARG 301 NH2 /I DC 47 OP1 /A ARG 301 HH21 3.241 2.383 |
| 6028 | | /A PHE 303 N /H DC 13 OP1 /A PHE 303 H 2.683 1.713 |
| 6029 | | /A LYS 305 NZ /H DA 14 OP1 /A LYS 305 HZ1 3.005 2.074 |
| 6030 | | /A ASN 435 ND2 /H DC 13 OP2 /A ASN 435 HD22 2.896 1.911 |
| 6031 | | /A ASN 436 ND2 /H DC 13 OP2 /A ASN 436 HD22 3.172 2.251 |
| 6032 | | /B LYS 148 NZ /I DG 19 OP1 /B LYS 148 HZ3 2.880 2.062 |
| 6033 | | /B ARG 150 NH1 /H DG 35 O6 /B ARG 150 HH12 3.317 2.492 |
| 6034 | | /B ARG 150 NH1 /I DG 19 O6 /B ARG 150 HH12 3.200 2.518 |
| 6035 | | /B ARG 150 NH2 /H DG 35 O6 /B ARG 150 HH22 2.932 1.954 |
| 6036 | | /B GLY 153 N /H DT 34 OP2 /B GLY 153 H 2.955 1.965 |
| 6037 | | /B LYS 248 NZ /I DA 37 O3' /B LYS 248 HZ1 3.058 2.307 |
| 6038 | | /B LYS 279 N /I DA 39 OP1 /B LYS 279 H 3.012 2.176 |
| 6039 | | /B ASP 280 N /I DA 39 OP1 /B ASP 280 H 3.419 2.439 |
| 6040 | | /C LYS 188 NZ /H DT 18 OP1 /C LYS 188 HZ1 2.597 1.602 |
| 6041 | | /C ARG 219 N /I DT 41 OP1 /C ARG 219 H 2.860 1.859 |
| 6042 | | /C ARG 219 NH1 /I DT 40 OP1 /C ARG 219 HH11 2.808 2.044 |
| 6043 | | /C ARG 220 NH1 /H DT 16 O2 /C ARG 220 HH11 3.328 2.600 |
| 6044 | | /C ARG 220 NH1 /I DT 40 O2 /C ARG 220 HH11 3.062 2.380 |
| 6045 | | /C TYR 223 OH /H DA 17 O3' /C TYR 223 HH 2.926 2.064 |
| 6046 | | /C TYR 607 OH /H DC 32 OP2 /C TYR 607 HH 3.278 2.327 |
| 6047 | | /C ARG 672 N /H DC 32 OP1 /C ARG 672 H 2.895 1.905 |
| 6048 | | /C ARG 672 NH1 /I DT 25 O2 /C ARG 672 HH12 2.707 1.845 |
| 6049 | | /C ARG 672 NH2 /I DT 25 O2 /C ARG 672 HH22 3.408 2.771 |
| 6050 | | /C LYS 673 NZ /H DA 33 OP1 /C LYS 673 HZ1 2.886 1.972 |
| 6051 | | /D LYS 168 NZ /H DA 14 N3 /D LYS 168 HZ1 2.838 1.847 |
| 6052 | | /D SER 169 OG /H DA 15 OP2 /D SER 169 HG 2.801 1.842 |
| 6053 | | /D ILE 170 N /H DA 15 OP2 /D ILE 170 H 3.077 2.202 |
| 6054 | | /D SER 463 OG /I DG 30 OP1 /D SER 463 HG 2.493 1.565 |
| 6055 | | /D LYS 465 NZ /I DG 31 O6 /D LYS 465 HZ1 2.363 1.498 |
| 6056 | | /D LYS 465 NZ /I DG 32 O6 /D LYS 465 HZ2 2.546 1.684 |
| 6057 | | /E ARG 76 NH1 /H DA 17 OP1 /E ARG 76 HH11 3.235 2.257 |
| 6058 | | /E ARG 340 NE /I DG 19 O5' /E ARG 340 HE 3.009 2.192 |
| 6059 | | /E ARG 340 NE /I DG 19 OP2 /E ARG 340 HE 2.873 1.974 |
| 6060 | | /E ARG 340 NH2 /I DG 19 OP2 /E ARG 340 HH21 3.300 2.551 |
| 6061 | | /E TYR 341 OH /I DC 20 OP1 /E TYR 341 HH 2.940 2.219 |
| 6062 | | /E ARG 357 NH1 /I DT 16 O2 /E ARG 357 HH12 2.784 1.882 |
| 6063 | | /E ARG 357 NH2 /I DT 16 O2 /E ARG 357 HH22 2.882 2.025 |
| 6064 | | /E ARG 357 NH2 /I DT 16 O4' /E ARG 357 HH22 3.135 2.386 |
| 6065 | | /E GLU 358 N /H DG 41 OP1 /E GLU 358 H 2.888 1.905 |
| 6066 | | /E THR 359 OG1 /I DG 19 OP1 /E THR 359 HG1 2.802 2.243 |
| 6067 | | /E ARG 362 N /I DG 19 O3' /E ARG 362 H 3.350 2.344 |
| 6068 | | /E ARG 362 NH1 /I DT 18 O2 /E ARG 362 HH12 2.975 2.081 |
| 6069 | | /E ARG 362 NH1 /I DG 19 O4' /E ARG 362 HH11 3.022 2.183 |
| 6070 | | /E ARG 362 NH2 /H DT 38 O2 /E ARG 362 HH22 2.881 2.130 |
| 6071 | | /E LYS 363 N /I DC 20 OP2 /E LYS 363 H 3.408 2.442 |
| 6072 | | /E LYS 363 NZ /I DA 21 OP1 /E LYS 363 HZ1 2.944 1.968 |
| 6073 | | /G GLY 546 N /H DA 27 OP1 /G GLY 546 H 2.915 2.028 |
| 6074 | | /G LYS 547 NZ /I DG 32 OP1 /G LYS 547 HZ1 2.552 1.558 |
| 6075 | | /G LYS 548 NZ /I DT 29 O2 /G LYS 548 HZ3 3.197 2.248 |
| 6076 | | /G ASN 553 N /I DG 32 OP2 /G ASN 553 H 2.957 2.079 |
| 6077 | | /G ARG 557 NH1 /I DG 34 O6 /G ARG 557 HH12 2.913 1.906 |
| 6078 | | /G ARG 557 NH2 /I DG 34 N7 /G ARG 557 HH22 2.372 1.443 |
| 6079 | | /G GLY 561 N /H DT 16 OP2 /G GLY 561 H 2.846 2.111 |
| 6080 | | /G THR 563 OG1 /H DT 16 OP1 /G THR 563 HG1 3.027 2.078 |
| 6081 | | /G ALA 565 N /H DA 17 OP2 /G ALA 565 H 2.576 1.574 |
| 6082 | | /G ARG 574 NH2 /I DG 32 OP1 /G ARG 574 HH21 3.076 2.128 |
| 6083 | | /G LYS 581 NZ /H DA 26 OP2 /G LYS 581 HZ1 3.143 2.140 |
| 6084 | | |
| 6085 | | |
| 6086 | | |
| 6087 | | 61 hydrogen bonds found |
| 6088 | | 21 strict hydrogen bonds found |
| 6089 | | |
| 6090 | | > hbonds sel saveFile "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 6091 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 6092 | | > structures/PDBs/ylODC_54bp-oriC061_complete/hbond-generation2_relaxed40" |
| 6093 | | > restrict #1/A,B,C,D,E,F,G angleSlop 40.0 twoColors true intraRes false |
| 6094 | | > reveal true log true |
| 6095 | | |
| 6096 | | |
| 6097 | | Finding intermodel H-bonds |
| 6098 | | Finding intramodel H-bonds |
| 6099 | | Constraints relaxed by 0.4 angstroms and 40 degrees |
| 6100 | | Models used: |
| 6101 | | 1 ylODC_54bpOriC061_rev30_PostPhenix.pdb |
| 6102 | | |
| 6103 | | 74 H-bonds |
| 6104 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 6105 | | /A ARG 301 NE /I DC 47 OP1 /A ARG 301 HE 3.042 2.096 |
| 6106 | | /A ARG 301 NH1 /H DT 10 O2 /A ARG 301 HH12 2.780 1.937 |
| 6107 | | /A ARG 301 NH1 /H DC 11 O4' /A ARG 301 HH11 2.808 1.918 |
| 6108 | | /A ARG 301 NH2 /I DT 46 O2 /A ARG 301 HH22 3.419 2.726 |
| 6109 | | /A ARG 301 NH2 /I DC 47 OP1 /A ARG 301 HH21 3.241 2.383 |
| 6110 | | /A PHE 303 N /H DC 13 OP1 /A PHE 303 H 2.683 1.713 |
| 6111 | | /A LYS 305 NZ /H DA 14 OP1 /A LYS 305 HZ1 3.005 2.074 |
| 6112 | | /A ASN 435 ND2 /H DC 13 OP2 /A ASN 435 HD22 2.896 1.911 |
| 6113 | | /A ASN 436 ND2 /H DC 13 OP2 /A ASN 436 HD22 3.172 2.251 |
| 6114 | | /B LYS 148 NZ /I DG 19 OP1 /B LYS 148 HZ3 2.880 2.062 |
| 6115 | | /B ARG 150 NH1 /H DG 35 O6 /B ARG 150 HH12 3.317 2.492 |
| 6116 | | /B ARG 150 NH1 /I DG 19 O6 /B ARG 150 HH12 3.200 2.518 |
| 6117 | | /B ARG 150 NH2 /H DG 35 O6 /B ARG 150 HH22 2.932 1.954 |
| 6118 | | /B GLY 153 N /H DT 34 OP2 /B GLY 153 H 2.955 1.965 |
| 6119 | | /B LYS 248 NZ /I DA 37 O3' /B LYS 248 HZ1 3.058 2.307 |
| 6120 | | /B LYS 279 N /I DA 39 OP1 /B LYS 279 H 3.012 2.176 |
| 6121 | | /B ASP 280 N /I DA 39 OP1 /B ASP 280 H 3.419 2.439 |
| 6122 | | /C LYS 188 NZ /H DT 18 OP1 /C LYS 188 HZ1 2.597 1.602 |
| 6123 | | /C ARG 219 N /I DT 41 OP1 /C ARG 219 H 2.860 1.859 |
| 6124 | | /C ARG 219 NH1 /I DT 40 OP1 /C ARG 219 HH11 2.808 2.044 |
| 6125 | | /C ARG 220 NH1 /H DA 15 N3 /C ARG 220 HH12 3.522 2.929 |
| 6126 | | /C ARG 220 NH1 /H DT 16 O2 /C ARG 220 HH11 3.328 2.600 |
| 6127 | | /C ARG 220 NH1 /I DT 40 O2 /C ARG 220 HH11 3.062 2.380 |
| 6128 | | /C TYR 223 OH /H DA 17 O3' /C TYR 223 HH 2.926 2.064 |
| 6129 | | /C TYR 607 OH /H DC 32 OP2 /C TYR 607 HH 3.278 2.327 |
| 6130 | | /C LYS 671 N /H DC 32 OP1 /C LYS 671 H 2.864 2.159 |
| 6131 | | /C ARG 672 N /H DC 32 OP1 /C ARG 672 H 2.895 1.905 |
| 6132 | | /C ARG 672 NH1 /I DT 25 O2 /C ARG 672 HH12 2.707 1.845 |
| 6133 | | /C ARG 672 NH2 /I DT 25 O2 /C ARG 672 HH22 3.408 2.771 |
| 6134 | | /C LYS 673 NZ /H DA 33 OP1 /C LYS 673 HZ1 2.886 1.972 |
| 6135 | | /D LYS 168 NZ /H DA 14 N3 /D LYS 168 HZ1 2.838 1.847 |
| 6136 | | /D SER 169 OG /H DA 14 O3' /D SER 169 HG 3.382 2.801 |
| 6137 | | /D SER 169 OG /H DA 15 OP2 /D SER 169 HG 2.801 1.842 |
| 6138 | | /D ILE 170 N /H DA 15 OP2 /D ILE 170 H 3.077 2.202 |
| 6139 | | /D SER 463 OG /I DG 30 OP1 /D SER 463 HG 2.493 1.565 |
| 6140 | | /D LYS 465 NZ /I DG 31 N7 /D LYS 465 HZ1 3.444 2.853 |
| 6141 | | /D LYS 465 NZ /I DG 31 O6 /D LYS 465 HZ1 2.363 1.498 |
| 6142 | | /D LYS 465 NZ /I DG 32 O6 /D LYS 465 HZ2 2.546 1.684 |
| 6143 | | /E ARG 76 NH1 /H DA 17 OP1 /E ARG 76 HH11 3.235 2.257 |
| 6144 | | /E ARG 340 NE /I DG 19 O5' /E ARG 340 HE 3.009 2.192 |
| 6145 | | /E ARG 340 NE /I DG 19 OP2 /E ARG 340 HE 2.873 1.974 |
| 6146 | | /E ARG 340 NH2 /I DG 19 OP2 /E ARG 340 HH21 3.300 2.551 |
| 6147 | | /E TYR 341 OH /I DC 20 OP1 /E TYR 341 HH 2.940 2.219 |
| 6148 | | /E ARG 357 NH1 /I DT 16 O2 /E ARG 357 HH12 2.784 1.882 |
| 6149 | | /E ARG 357 NH2 /I DT 16 O2 /E ARG 357 HH22 2.882 2.025 |
| 6150 | | /E ARG 357 NH2 /I DT 16 O4' /E ARG 357 HH22 3.135 2.386 |
| 6151 | | /E GLU 358 N /H DG 41 OP1 /E GLU 358 H 2.888 1.905 |
| 6152 | | /E THR 359 OG1 /I DG 19 OP1 /E THR 359 HG1 2.802 2.243 |
| 6153 | | /E ARG 362 N /I DG 19 O3' /E ARG 362 H 3.350 2.344 |
| 6154 | | /E ARG 362 NH1 /I DT 18 O2 /E ARG 362 HH12 2.975 2.081 |
| 6155 | | /E ARG 362 NH1 /I DG 19 O4' /E ARG 362 HH11 3.022 2.183 |
| 6156 | | /E ARG 362 NH2 /H DT 38 O2 /E ARG 362 HH22 2.881 2.130 |
| 6157 | | /E ARG 362 NH2 /H DA 39 O4' /E ARG 362 HH21 3.366 2.779 |
| 6158 | | /E LYS 363 N /I DC 20 OP2 /E LYS 363 H 3.408 2.442 |
| 6159 | | /E LYS 363 NZ /I DA 21 OP1 /E LYS 363 HZ1 2.944 1.968 |
| 6160 | | /G GLY 543 N /H DA 26 OP1 /G GLY 543 H 2.943 2.343 |
| 6161 | | /G GLY 546 N /H DA 27 OP1 /G GLY 546 H 2.915 2.028 |
| 6162 | | /G LYS 547 NZ /I DG 31 O3' /G LYS 547 HZ2 2.870 2.326 |
| 6163 | | /G LYS 547 NZ /I DG 32 OP1 /G LYS 547 HZ1 2.552 1.558 |
| 6164 | | /G LYS 548 NZ /H DA 27 N3 /G LYS 548 HZ1 2.902 2.236 |
| 6165 | | /G LYS 548 NZ /H DG 28 O4' /G LYS 548 HZ2 2.987 2.212 |
| 6166 | | /G LYS 548 NZ /I DT 29 O2 /G LYS 548 HZ3 3.197 2.248 |
| 6167 | | /G ASN 553 N /I DG 32 OP2 /G ASN 553 H 2.957 2.079 |
| 6168 | | /G ARG 557 NH1 /I DG 34 O6 /G ARG 557 HH12 2.913 1.906 |
| 6169 | | /G ARG 557 NH2 /I DG 34 N7 /G ARG 557 HH22 2.372 1.443 |
| 6170 | | /G LYS 560 NZ /H DA 15 OP1 /G LYS 560 HZ3 3.180 2.601 |
| 6171 | | /G GLY 561 N /H DT 16 OP1 /G GLY 561 H 3.390 2.598 |
| 6172 | | /G GLY 561 N /H DT 16 OP2 /G GLY 561 H 2.846 2.111 |
| 6173 | | /G THR 563 N /H DT 16 OP1 /G THR 563 H 2.931 2.306 |
| 6174 | | /G THR 563 OG1 /H DT 16 OP1 /G THR 563 HG1 3.027 2.078 |
| 6175 | | /G ALA 565 N /H DA 17 OP2 /G ALA 565 H 2.576 1.574 |
| 6176 | | /G ARG 574 NH2 /I DG 32 OP1 /G ARG 574 HH21 3.076 2.128 |
| 6177 | | /G LYS 581 NZ /H DA 26 O5' /G LYS 581 HZ1 3.367 2.792 |
| 6178 | | /G LYS 581 NZ /H DA 26 OP2 /G LYS 581 HZ1 3.143 2.140 |
| 6179 | | |
| 6180 | | |
| 6181 | | |
| 6182 | | 74 hydrogen bonds found |
| 6183 | | 21 strict hydrogen bonds found |
| 6184 | | |
| 6185 | | > hbonds sel saveFile "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 6186 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 6187 | | > structures/PDBs/ylODC_54bp-oriC061_complete/hbond-generation2_relaxed40" |
| 6188 | | > restrict #1/A,B,C,D,E,F,G angleSlop 40.0 twoColors true intraRes false |
| 6189 | | > select true reveal true log true |
| 6190 | | |
| 6191 | | |
| 6192 | | Finding intermodel H-bonds |
| 6193 | | Finding intramodel H-bonds |
| 6194 | | Constraints relaxed by 0.4 angstroms and 40 degrees |
| 6195 | | Models used: |
| 6196 | | 1 ylODC_54bpOriC061_rev30_PostPhenix.pdb |
| 6197 | | |
| 6198 | | 74 H-bonds |
| 6199 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 6200 | | /A ARG 301 NE /I DC 47 OP1 /A ARG 301 HE 3.042 2.096 |
| 6201 | | /A ARG 301 NH1 /H DT 10 O2 /A ARG 301 HH12 2.780 1.937 |
| 6202 | | /A ARG 301 NH1 /H DC 11 O4' /A ARG 301 HH11 2.808 1.918 |
| 6203 | | /A ARG 301 NH2 /I DT 46 O2 /A ARG 301 HH22 3.419 2.726 |
| 6204 | | /A ARG 301 NH2 /I DC 47 OP1 /A ARG 301 HH21 3.241 2.383 |
| 6205 | | /A PHE 303 N /H DC 13 OP1 /A PHE 303 H 2.683 1.713 |
| 6206 | | /A LYS 305 NZ /H DA 14 OP1 /A LYS 305 HZ1 3.005 2.074 |
| 6207 | | /A ASN 435 ND2 /H DC 13 OP2 /A ASN 435 HD22 2.896 1.911 |
| 6208 | | /A ASN 436 ND2 /H DC 13 OP2 /A ASN 436 HD22 3.172 2.251 |
| 6209 | | /B LYS 148 NZ /I DG 19 OP1 /B LYS 148 HZ3 2.880 2.062 |
| 6210 | | /B ARG 150 NH1 /H DG 35 O6 /B ARG 150 HH12 3.317 2.492 |
| 6211 | | /B ARG 150 NH1 /I DG 19 O6 /B ARG 150 HH12 3.200 2.518 |
| 6212 | | /B ARG 150 NH2 /H DG 35 O6 /B ARG 150 HH22 2.932 1.954 |
| 6213 | | /B GLY 153 N /H DT 34 OP2 /B GLY 153 H 2.955 1.965 |
| 6214 | | /B LYS 248 NZ /I DA 37 O3' /B LYS 248 HZ1 3.058 2.307 |
| 6215 | | /B LYS 279 N /I DA 39 OP1 /B LYS 279 H 3.012 2.176 |
| 6216 | | /B ASP 280 N /I DA 39 OP1 /B ASP 280 H 3.419 2.439 |
| 6217 | | /C LYS 188 NZ /H DT 18 OP1 /C LYS 188 HZ1 2.597 1.602 |
| 6218 | | /C ARG 219 N /I DT 41 OP1 /C ARG 219 H 2.860 1.859 |
| 6219 | | /C ARG 219 NH1 /I DT 40 OP1 /C ARG 219 HH11 2.808 2.044 |
| 6220 | | /C ARG 220 NH1 /H DA 15 N3 /C ARG 220 HH12 3.522 2.929 |
| 6221 | | /C ARG 220 NH1 /H DT 16 O2 /C ARG 220 HH11 3.328 2.600 |
| 6222 | | /C ARG 220 NH1 /I DT 40 O2 /C ARG 220 HH11 3.062 2.380 |
| 6223 | | /C TYR 223 OH /H DA 17 O3' /C TYR 223 HH 2.926 2.064 |
| 6224 | | /C TYR 607 OH /H DC 32 OP2 /C TYR 607 HH 3.278 2.327 |
| 6225 | | /C LYS 671 N /H DC 32 OP1 /C LYS 671 H 2.864 2.159 |
| 6226 | | /C ARG 672 N /H DC 32 OP1 /C ARG 672 H 2.895 1.905 |
| 6227 | | /C ARG 672 NH1 /I DT 25 O2 /C ARG 672 HH12 2.707 1.845 |
| 6228 | | /C ARG 672 NH2 /I DT 25 O2 /C ARG 672 HH22 3.408 2.771 |
| 6229 | | /C LYS 673 NZ /H DA 33 OP1 /C LYS 673 HZ1 2.886 1.972 |
| 6230 | | /D LYS 168 NZ /H DA 14 N3 /D LYS 168 HZ1 2.838 1.847 |
| 6231 | | /D SER 169 OG /H DA 14 O3' /D SER 169 HG 3.382 2.801 |
| 6232 | | /D SER 169 OG /H DA 15 OP2 /D SER 169 HG 2.801 1.842 |
| 6233 | | /D ILE 170 N /H DA 15 OP2 /D ILE 170 H 3.077 2.202 |
| 6234 | | /D SER 463 OG /I DG 30 OP1 /D SER 463 HG 2.493 1.565 |
| 6235 | | /D LYS 465 NZ /I DG 31 N7 /D LYS 465 HZ1 3.444 2.853 |
| 6236 | | /D LYS 465 NZ /I DG 31 O6 /D LYS 465 HZ1 2.363 1.498 |
| 6237 | | /D LYS 465 NZ /I DG 32 O6 /D LYS 465 HZ2 2.546 1.684 |
| 6238 | | /E ARG 76 NH1 /H DA 17 OP1 /E ARG 76 HH11 3.235 2.257 |
| 6239 | | /E ARG 340 NE /I DG 19 O5' /E ARG 340 HE 3.009 2.192 |
| 6240 | | /E ARG 340 NE /I DG 19 OP2 /E ARG 340 HE 2.873 1.974 |
| 6241 | | /E ARG 340 NH2 /I DG 19 OP2 /E ARG 340 HH21 3.300 2.551 |
| 6242 | | /E TYR 341 OH /I DC 20 OP1 /E TYR 341 HH 2.940 2.219 |
| 6243 | | /E ARG 357 NH1 /I DT 16 O2 /E ARG 357 HH12 2.784 1.882 |
| 6244 | | /E ARG 357 NH2 /I DT 16 O2 /E ARG 357 HH22 2.882 2.025 |
| 6245 | | /E ARG 357 NH2 /I DT 16 O4' /E ARG 357 HH22 3.135 2.386 |
| 6246 | | /E GLU 358 N /H DG 41 OP1 /E GLU 358 H 2.888 1.905 |
| 6247 | | /E THR 359 OG1 /I DG 19 OP1 /E THR 359 HG1 2.802 2.243 |
| 6248 | | /E ARG 362 N /I DG 19 O3' /E ARG 362 H 3.350 2.344 |
| 6249 | | /E ARG 362 NH1 /I DT 18 O2 /E ARG 362 HH12 2.975 2.081 |
| 6250 | | /E ARG 362 NH1 /I DG 19 O4' /E ARG 362 HH11 3.022 2.183 |
| 6251 | | /E ARG 362 NH2 /H DT 38 O2 /E ARG 362 HH22 2.881 2.130 |
| 6252 | | /E ARG 362 NH2 /H DA 39 O4' /E ARG 362 HH21 3.366 2.779 |
| 6253 | | /E LYS 363 N /I DC 20 OP2 /E LYS 363 H 3.408 2.442 |
| 6254 | | /E LYS 363 NZ /I DA 21 OP1 /E LYS 363 HZ1 2.944 1.968 |
| 6255 | | /G GLY 543 N /H DA 26 OP1 /G GLY 543 H 2.943 2.343 |
| 6256 | | /G GLY 546 N /H DA 27 OP1 /G GLY 546 H 2.915 2.028 |
| 6257 | | /G LYS 547 NZ /I DG 31 O3' /G LYS 547 HZ2 2.870 2.326 |
| 6258 | | /G LYS 547 NZ /I DG 32 OP1 /G LYS 547 HZ1 2.552 1.558 |
| 6259 | | /G LYS 548 NZ /H DA 27 N3 /G LYS 548 HZ1 2.902 2.236 |
| 6260 | | /G LYS 548 NZ /H DG 28 O4' /G LYS 548 HZ2 2.987 2.212 |
| 6261 | | /G LYS 548 NZ /I DT 29 O2 /G LYS 548 HZ3 3.197 2.248 |
| 6262 | | /G ASN 553 N /I DG 32 OP2 /G ASN 553 H 2.957 2.079 |
| 6263 | | /G ARG 557 NH1 /I DG 34 O6 /G ARG 557 HH12 2.913 1.906 |
| 6264 | | /G ARG 557 NH2 /I DG 34 N7 /G ARG 557 HH22 2.372 1.443 |
| 6265 | | /G LYS 560 NZ /H DA 15 OP1 /G LYS 560 HZ3 3.180 2.601 |
| 6266 | | /G GLY 561 N /H DT 16 OP1 /G GLY 561 H 3.390 2.598 |
| 6267 | | /G GLY 561 N /H DT 16 OP2 /G GLY 561 H 2.846 2.111 |
| 6268 | | /G THR 563 N /H DT 16 OP1 /G THR 563 H 2.931 2.306 |
| 6269 | | /G THR 563 OG1 /H DT 16 OP1 /G THR 563 HG1 3.027 2.078 |
| 6270 | | /G ALA 565 N /H DA 17 OP2 /G ALA 565 H 2.576 1.574 |
| 6271 | | /G ARG 574 NH2 /I DG 32 OP1 /G ARG 574 HH21 3.076 2.128 |
| 6272 | | /G LYS 581 NZ /H DA 26 O5' /G LYS 581 HZ1 3.367 2.792 |
| 6273 | | /G LYS 581 NZ /H DA 26 OP2 /G LYS 581 HZ1 3.143 2.140 |
| 6274 | | |
| 6275 | | |
| 6276 | | |
| 6277 | | 74 hydrogen bonds found |
| 6278 | | 21 strict hydrogen bonds found |
| 6279 | | |
| 6280 | | > select up |
| 6281 | | |
| 6282 | | 1950 atoms, 1998 bonds, 79 residues, 1 model selected |
| 6283 | | |
| 6284 | | > show sel atoms |
| 6285 | | |
| 6286 | | > select clear |
| 6287 | | |
| 6288 | | > select ~nucleic |
| 6289 | | |
| 6290 | | 47733 atoms, 48183 bonds, 11 pseudobonds, 2978 residues, 3 models selected |
| 6291 | | |
| 6292 | | > hide sel cartoons |
| 6293 | | |
| 6294 | | > select clear |
| 6295 | | |
| 6296 | | > save "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 6297 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 6298 | | > structures/PDBs/ylODC_54bp-oriC061_complete/new_hbond_ver30.cxs" |
| 6299 | | |
| 6300 | | > select /G:548@NZ |
| 6301 | | |
| 6302 | | 1 atom, 1 residue, 1 model selected |
| 6303 | | |
| 6304 | | > select /I:29@N3 |
| 6305 | | |
| 6306 | | 1 atom, 1 residue, 1 model selected |
| 6307 | | |
| 6308 | | > select /I:30 |
| 6309 | | |
| 6310 | | 33 atoms, 35 bonds, 1 residue, 1 model selected |
| 6311 | | |
| 6312 | | > select /I:29 |
| 6313 | | |
| 6314 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 6315 | | |
| 6316 | | > select /H:26 |
| 6317 | | |
| 6318 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 6319 | | |
| 6320 | | > ui tool show "Renumber Residues" |
| 6321 | | |
| 6322 | | > renumber /H start -7 |
| 6323 | | |
| 6324 | | 37 residues renumbered |
| 6325 | | |
| 6326 | | > select /H:12 |
| 6327 | | |
| 6328 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 6329 | | |
| 6330 | | > select /H:11 |
| 6331 | | |
| 6332 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 6333 | | |
| 6334 | | > renumber /H start -16 |
| 6335 | | |
| 6336 | | 37 residues renumbered |
| 6337 | | |
| 6338 | | > renumber /H start -16 |
| 6339 | | |
| 6340 | | 0 residues renumbered |
| 6341 | | |
| 6342 | | > renumber /H start -16 |
| 6343 | | |
| 6344 | | 0 residues renumbered |
| 6345 | | |
| 6346 | | > select /H:3 |
| 6347 | | |
| 6348 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 6349 | | |
| 6350 | | > select /H:2 |
| 6351 | | |
| 6352 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 6353 | | |
| 6354 | | > renumber /H start -18 |
| 6355 | | |
| 6356 | | 37 residues renumbered |
| 6357 | | |
| 6358 | | > select /H:0 |
| 6359 | | |
| 6360 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 6361 | | |
| 6362 | | > save "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 6363 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 6364 | | > structures/PDBs/ylODC_54bp-oriC061_complete/new_hbond_ver30.cxs" |
| 6365 | | |
| 6366 | | > select /I:29 |
| 6367 | | |
| 6368 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 6369 | | |
| 6370 | | > ui tool show "Renumber Residues" |
| 6371 | | |
| 6372 | | > renumber /I start -15 |
| 6373 | | |
| 6374 | | 35 residues renumbered |
| 6375 | | |
| 6376 | | > select /I:1 |
| 6377 | | |
| 6378 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 6379 | | |
| 6380 | | > renumber /I start -16 |
| 6381 | | |
| 6382 | | 35 residues renumbered |
| 6383 | | |
| 6384 | | > renumber /I start -16 |
| 6385 | | |
| 6386 | | 0 residues renumbered |
| 6387 | | |
| 6388 | | > select clear |
| 6389 | | |
| 6390 | | > save "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 6391 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 6392 | | > structures/PDBs/ylODC_54bp-oriC061_complete/new_hbond_ver30.cxs" |
| 6393 | | |
| 6394 | | > hbonds sel saveFile "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 6395 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 6396 | | > structures/PDBs/ylODC_54bp-oriC061_complete/new_hbond_ver30" restrict |
| 6397 | | > #1/A,B,C,D,E,F,G angleSlop 40.0 twoColors true intraRes false select true |
| 6398 | | > reveal true log true |
| 6399 | | |
| 6400 | | Atom specifier selects no atoms |
| 6401 | | |
| 6402 | | > select nucleic |
| 6403 | | |
| 6404 | | 2291 atoms, 2469 bonds, 72 residues, 1 model selected |
| 6405 | | |
| 6406 | | > hbonds sel saveFile "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 6407 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 6408 | | > structures/PDBs/ylODC_54bp-oriC061_complete/hbond-generation2_relaxed40" |
| 6409 | | > restrict #1/A,B,C,D,E,F,G angleSlop 40.0 twoColors true intraRes false |
| 6410 | | > select true reveal true log true |
| 6411 | | |
| 6412 | | |
| 6413 | | Finding intermodel H-bonds |
| 6414 | | Finding intramodel H-bonds |
| 6415 | | Constraints relaxed by 0.4 angstroms and 40 degrees |
| 6416 | | Models used: |
| 6417 | | 1 ylODC_54bpOriC061_rev30_PostPhenix.pdb |
| 6418 | | |
| 6419 | | 74 H-bonds |
| 6420 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 6421 | | /A ARG 301 NE /I DC 18 OP1 /A ARG 301 HE 3.042 2.096 |
| 6422 | | /A ARG 301 NH1 /H DT -16 O2 /A ARG 301 HH12 2.780 1.937 |
| 6423 | | /A ARG 301 NH1 /H DC -15 O4' /A ARG 301 HH11 2.808 1.918 |
| 6424 | | /A ARG 301 NH2 /I DT 17 O2 /A ARG 301 HH22 3.419 2.726 |
| 6425 | | /A ARG 301 NH2 /I DC 18 OP1 /A ARG 301 HH21 3.241 2.383 |
| 6426 | | /A PHE 303 N /H DC -13 OP1 /A PHE 303 H 2.683 1.713 |
| 6427 | | /A LYS 305 NZ /H DA -12 OP1 /A LYS 305 HZ1 3.005 2.074 |
| 6428 | | /A ASN 435 ND2 /H DC -13 OP2 /A ASN 435 HD22 2.896 1.911 |
| 6429 | | /A ASN 436 ND2 /H DC -13 OP2 /A ASN 436 HD22 3.172 2.251 |
| 6430 | | /B LYS 148 NZ /I DG -10 OP1 /B LYS 148 HZ3 2.880 2.062 |
| 6431 | | /B ARG 150 NH1 /H DG 9 O6 /B ARG 150 HH12 3.317 2.492 |
| 6432 | | /B ARG 150 NH1 /I DG -10 O6 /B ARG 150 HH12 3.200 2.518 |
| 6433 | | /B ARG 150 NH2 /H DG 9 O6 /B ARG 150 HH22 2.932 1.954 |
| 6434 | | /B GLY 153 N /H DT 8 OP2 /B GLY 153 H 2.955 1.965 |
| 6435 | | /B LYS 248 NZ /I DA 8 O3' /B LYS 248 HZ1 3.058 2.307 |
| 6436 | | /B LYS 279 N /I DA 10 OP1 /B LYS 279 H 3.012 2.176 |
| 6437 | | /B ASP 280 N /I DA 10 OP1 /B ASP 280 H 3.419 2.439 |
| 6438 | | /C LYS 188 NZ /H DT -8 OP1 /C LYS 188 HZ1 2.597 1.602 |
| 6439 | | /C ARG 219 N /I DT 12 OP1 /C ARG 219 H 2.860 1.859 |
| 6440 | | /C ARG 219 NH1 /I DT 11 OP1 /C ARG 219 HH11 2.808 2.044 |
| 6441 | | /C ARG 220 NH1 /H DA -11 N3 /C ARG 220 HH12 3.522 2.929 |
| 6442 | | /C ARG 220 NH1 /H DT -10 O2 /C ARG 220 HH11 3.328 2.600 |
| 6443 | | /C ARG 220 NH1 /I DT 11 O2 /C ARG 220 HH11 3.062 2.380 |
| 6444 | | /C TYR 223 OH /H DA -9 O3' /C TYR 223 HH 2.926 2.064 |
| 6445 | | /C TYR 607 OH /H DC 6 OP2 /C TYR 607 HH 3.278 2.327 |
| 6446 | | /C LYS 671 N /H DC 6 OP1 /C LYS 671 H 2.864 2.159 |
| 6447 | | /C ARG 672 N /H DC 6 OP1 /C ARG 672 H 2.895 1.905 |
| 6448 | | /C ARG 672 NH1 /I DT -4 O2 /C ARG 672 HH12 2.707 1.845 |
| 6449 | | /C ARG 672 NH2 /I DT -4 O2 /C ARG 672 HH22 3.408 2.771 |
| 6450 | | /C LYS 673 NZ /H DA 7 OP1 /C LYS 673 HZ1 2.886 1.972 |
| 6451 | | /D LYS 168 NZ /H DA -12 N3 /D LYS 168 HZ1 2.838 1.847 |
| 6452 | | /D SER 169 OG /H DA -12 O3' /D SER 169 HG 3.382 2.801 |
| 6453 | | /D SER 169 OG /H DA -11 OP2 /D SER 169 HG 2.801 1.842 |
| 6454 | | /D ILE 170 N /H DA -11 OP2 /D ILE 170 H 3.077 2.202 |
| 6455 | | /D SER 463 OG /I DG 1 OP1 /D SER 463 HG 2.493 1.565 |
| 6456 | | /D LYS 465 NZ /I DG 2 N7 /D LYS 465 HZ1 3.444 2.853 |
| 6457 | | /D LYS 465 NZ /I DG 2 O6 /D LYS 465 HZ1 2.363 1.498 |
| 6458 | | /D LYS 465 NZ /I DG 3 O6 /D LYS 465 HZ2 2.546 1.684 |
| 6459 | | /E ARG 76 NH1 /H DA -9 OP1 /E ARG 76 HH11 3.235 2.257 |
| 6460 | | /E ARG 340 NE /I DG -10 O5' /E ARG 340 HE 3.009 2.192 |
| 6461 | | /E ARG 340 NE /I DG -10 OP2 /E ARG 340 HE 2.873 1.974 |
| 6462 | | /E ARG 340 NH2 /I DG -10 OP2 /E ARG 340 HH21 3.300 2.551 |
| 6463 | | /E TYR 341 OH /I DC -9 OP1 /E TYR 341 HH 2.940 2.219 |
| 6464 | | /E ARG 357 NH1 /I DT -13 O2 /E ARG 357 HH12 2.784 1.882 |
| 6465 | | /E ARG 357 NH2 /I DT -13 O2 /E ARG 357 HH22 2.882 2.025 |
| 6466 | | /E ARG 357 NH2 /I DT -13 O4' /E ARG 357 HH22 3.135 2.386 |
| 6467 | | /E GLU 358 N /H DG 15 OP1 /E GLU 358 H 2.888 1.905 |
| 6468 | | /E THR 359 OG1 /I DG -10 OP1 /E THR 359 HG1 2.802 2.243 |
| 6469 | | /E ARG 362 N /I DG -10 O3' /E ARG 362 H 3.350 2.344 |
| 6470 | | /E ARG 362 NH1 /I DT -11 O2 /E ARG 362 HH12 2.975 2.081 |
| 6471 | | /E ARG 362 NH1 /I DG -10 O4' /E ARG 362 HH11 3.022 2.183 |
| 6472 | | /E ARG 362 NH2 /H DT 12 O2 /E ARG 362 HH22 2.881 2.130 |
| 6473 | | /E ARG 362 NH2 /H DA 13 O4' /E ARG 362 HH21 3.366 2.779 |
| 6474 | | /E LYS 363 N /I DC -9 OP2 /E LYS 363 H 3.408 2.442 |
| 6475 | | /E LYS 363 NZ /I DA -8 OP1 /E LYS 363 HZ1 2.944 1.968 |
| 6476 | | /G GLY 543 N /H DA 0 OP1 /G GLY 543 H 2.943 2.343 |
| 6477 | | /G GLY 546 N /H DA 1 OP1 /G GLY 546 H 2.915 2.028 |
| 6478 | | /G LYS 547 NZ /I DG 2 O3' /G LYS 547 HZ2 2.870 2.326 |
| 6479 | | /G LYS 547 NZ /I DG 3 OP1 /G LYS 547 HZ1 2.552 1.558 |
| 6480 | | /G LYS 548 NZ /H DA 1 N3 /G LYS 548 HZ1 2.902 2.236 |
| 6481 | | /G LYS 548 NZ /H DG 2 O4' /G LYS 548 HZ2 2.987 2.212 |
| 6482 | | /G LYS 548 NZ /I DT 0 O2 /G LYS 548 HZ3 3.197 2.248 |
| 6483 | | /G ASN 553 N /I DG 3 OP2 /G ASN 553 H 2.957 2.079 |
| 6484 | | /G ARG 557 NH1 /I DG 5 O6 /G ARG 557 HH12 2.913 1.906 |
| 6485 | | /G ARG 557 NH2 /I DG 5 N7 /G ARG 557 HH22 2.372 1.443 |
| 6486 | | /G LYS 560 NZ /H DA -11 OP1 /G LYS 560 HZ3 3.180 2.601 |
| 6487 | | /G GLY 561 N /H DT -10 OP1 /G GLY 561 H 3.390 2.598 |
| 6488 | | /G GLY 561 N /H DT -10 OP2 /G GLY 561 H 2.846 2.111 |
| 6489 | | /G THR 563 N /H DT -10 OP1 /G THR 563 H 2.931 2.306 |
| 6490 | | /G THR 563 OG1 /H DT -10 OP1 /G THR 563 HG1 3.027 2.078 |
| 6491 | | /G ALA 565 N /H DA -9 OP2 /G ALA 565 H 2.576 1.574 |
| 6492 | | /G ARG 574 NH2 /I DG 3 OP1 /G ARG 574 HH21 3.076 2.128 |
| 6493 | | /G LYS 581 NZ /H DA 0 O5' /G LYS 581 HZ1 3.367 2.792 |
| 6494 | | /G LYS 581 NZ /H DA 0 OP2 /G LYS 581 HZ1 3.143 2.140 |
| 6495 | | |
| 6496 | | |
| 6497 | | |
| 6498 | | 74 hydrogen bonds found |
| 6499 | | 21 strict hydrogen bonds found |
| 6500 | | |
| 6501 | | > show sel atoms |
| 6502 | | |
| 6503 | | > select clear |
| 6504 | | |
| 6505 | | > ui tool show "Change Chain IDs" |
| 6506 | | |
| 6507 | | > changechains H main |
| 6508 | | |
| 6509 | | Proposed chain ID change would produce multiple residues with the samechain- |
| 6510 | | ID/number/insertion-code combo (main/299/) |
| 6511 | | |
| 6512 | | > changechains H main |
| 6513 | | |
| 6514 | | Proposed chain ID change would produce multiple residues with the samechain- |
| 6515 | | ID/number/insertion-code combo (main/299/) |
| 6516 | | |
| 6517 | | > changechains I opp |
| 6518 | | |
| 6519 | | No residues specified |
| 6520 | | |
| 6521 | | > changechains I opp |
| 6522 | | |
| 6523 | | No residues specified |
| 6524 | | |
| 6525 | | > changechains H main |
| 6526 | | |
| 6527 | | Proposed chain ID change would produce multiple residues with the samechain- |
| 6528 | | ID/number/insertion-code combo (main/299/) |
| 6529 | | |
| 6530 | | > select /H |
| 6531 | | |
| 6532 | | 1170 atoms, 1262 bonds, 37 residues, 1 model selected |
| 6533 | | |
| 6534 | | > changechains sel main |
| 6535 | | |
| 6536 | | Chain IDs of 37 residues changed |
| 6537 | | |
| 6538 | | > select /I |
| 6539 | | |
| 6540 | | 1121 atoms, 1207 bonds, 35 residues, 1 model selected |
| 6541 | | |
| 6542 | | > changechains sel opp |
| 6543 | | |
| 6544 | | Chain IDs of 35 residues changed |
| 6545 | | |
| 6546 | | > select clear |
| 6547 | | |
| 6548 | | > ui tool show H-Bonds |
| 6549 | | |
| 6550 | | > hbonds sel saveFile "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 6551 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 6552 | | > structures/PDBs/ylODC_54bp-oriC061_complete/hbond-generation2_relaxed40" |
| 6553 | | > restrict #1/A,B,C,D,E,F,G angleSlop 40.0 twoColors true intraRes false |
| 6554 | | > reveal true log true |
| 6555 | | |
| 6556 | | Atom specifier selects no atoms |
| 6557 | | |
| 6558 | | > select nucleic |
| 6559 | | |
| 6560 | | 2291 atoms, 2469 bonds, 72 residues, 1 model selected |
| 6561 | | |
| 6562 | | > hbonds sel saveFile "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 6563 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 6564 | | > structures/PDBs/ylODC_54bp-oriC061_complete/hbond-generation2_relaxed40" |
| 6565 | | > restrict #1/A,B,C,D,E,F,G angleSlop 40.0 twoColors true intraRes false |
| 6566 | | > reveal true log true |
| 6567 | | |
| 6568 | | |
| 6569 | | Finding intermodel H-bonds |
| 6570 | | Finding intramodel H-bonds |
| 6571 | | Constraints relaxed by 0.4 angstroms and 40 degrees |
| 6572 | | Models used: |
| 6573 | | 1 ylODC_54bpOriC061_rev30_PostPhenix.pdb |
| 6574 | | |
| 6575 | | 74 H-bonds |
| 6576 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 6577 | | /A ARG 301 NE /opp DC 18 OP1 /A ARG 301 HE 3.042 2.096 |
| 6578 | | /A ARG 301 NH1 /main DT -16 O2 /A ARG 301 HH12 2.780 1.937 |
| 6579 | | /A ARG 301 NH1 /main DC -15 O4' /A ARG 301 HH11 2.808 1.918 |
| 6580 | | /A ARG 301 NH2 /opp DT 17 O2 /A ARG 301 HH22 3.419 2.726 |
| 6581 | | /A ARG 301 NH2 /opp DC 18 OP1 /A ARG 301 HH21 3.241 2.383 |
| 6582 | | /A PHE 303 N /main DC -13 OP1 /A PHE 303 H 2.683 1.713 |
| 6583 | | /A LYS 305 NZ /main DA -12 OP1 /A LYS 305 HZ1 3.005 2.074 |
| 6584 | | /A ASN 435 ND2 /main DC -13 OP2 /A ASN 435 HD22 2.896 1.911 |
| 6585 | | /A ASN 436 ND2 /main DC -13 OP2 /A ASN 436 HD22 3.172 2.251 |
| 6586 | | /B LYS 148 NZ /opp DG -10 OP1 /B LYS 148 HZ3 2.880 2.062 |
| 6587 | | /B ARG 150 NH1 /main DG 9 O6 /B ARG 150 HH12 3.317 2.492 |
| 6588 | | /B ARG 150 NH1 /opp DG -10 O6 /B ARG 150 HH12 3.200 2.518 |
| 6589 | | /B ARG 150 NH2 /main DG 9 O6 /B ARG 150 HH22 2.932 1.954 |
| 6590 | | /B GLY 153 N /main DT 8 OP2 /B GLY 153 H 2.955 1.965 |
| 6591 | | /B LYS 248 NZ /opp DA 8 O3' /B LYS 248 HZ1 3.058 2.307 |
| 6592 | | /B LYS 279 N /opp DA 10 OP1 /B LYS 279 H 3.012 2.176 |
| 6593 | | /B ASP 280 N /opp DA 10 OP1 /B ASP 280 H 3.419 2.439 |
| 6594 | | /C LYS 188 NZ /main DT -8 OP1 /C LYS 188 HZ1 2.597 1.602 |
| 6595 | | /C ARG 219 N /opp DT 12 OP1 /C ARG 219 H 2.860 1.859 |
| 6596 | | /C ARG 219 NH1 /opp DT 11 OP1 /C ARG 219 HH11 2.808 2.044 |
| 6597 | | /C ARG 220 NH1 /main DA -11 N3 /C ARG 220 HH12 3.522 2.929 |
| 6598 | | /C ARG 220 NH1 /main DT -10 O2 /C ARG 220 HH11 3.328 2.600 |
| 6599 | | /C ARG 220 NH1 /opp DT 11 O2 /C ARG 220 HH11 3.062 2.380 |
| 6600 | | /C TYR 223 OH /main DA -9 O3' /C TYR 223 HH 2.926 2.064 |
| 6601 | | /C TYR 607 OH /main DC 6 OP2 /C TYR 607 HH 3.278 2.327 |
| 6602 | | /C LYS 671 N /main DC 6 OP1 /C LYS 671 H 2.864 2.159 |
| 6603 | | /C ARG 672 N /main DC 6 OP1 /C ARG 672 H 2.895 1.905 |
| 6604 | | /C ARG 672 NH1 /opp DT -4 O2 /C ARG 672 HH12 2.707 1.845 |
| 6605 | | /C ARG 672 NH2 /opp DT -4 O2 /C ARG 672 HH22 3.408 2.771 |
| 6606 | | /C LYS 673 NZ /main DA 7 OP1 /C LYS 673 HZ1 2.886 1.972 |
| 6607 | | /D LYS 168 NZ /main DA -12 N3 /D LYS 168 HZ1 2.838 1.847 |
| 6608 | | /D SER 169 OG /main DA -12 O3' /D SER 169 HG 3.382 2.801 |
| 6609 | | /D SER 169 OG /main DA -11 OP2 /D SER 169 HG 2.801 1.842 |
| 6610 | | /D ILE 170 N /main DA -11 OP2 /D ILE 170 H 3.077 2.202 |
| 6611 | | /D SER 463 OG /opp DG 1 OP1 /D SER 463 HG 2.493 1.565 |
| 6612 | | /D LYS 465 NZ /opp DG 2 N7 /D LYS 465 HZ1 3.444 2.853 |
| 6613 | | /D LYS 465 NZ /opp DG 2 O6 /D LYS 465 HZ1 2.363 1.498 |
| 6614 | | /D LYS 465 NZ /opp DG 3 O6 /D LYS 465 HZ2 2.546 1.684 |
| 6615 | | /E ARG 76 NH1 /main DA -9 OP1 /E ARG 76 HH11 3.235 2.257 |
| 6616 | | /E ARG 340 NE /opp DG -10 O5' /E ARG 340 HE 3.009 2.192 |
| 6617 | | /E ARG 340 NE /opp DG -10 OP2 /E ARG 340 HE 2.873 1.974 |
| 6618 | | /E ARG 340 NH2 /opp DG -10 OP2 /E ARG 340 HH21 3.300 2.551 |
| 6619 | | /E TYR 341 OH /opp DC -9 OP1 /E TYR 341 HH 2.940 2.219 |
| 6620 | | /E ARG 357 NH1 /opp DT -13 O2 /E ARG 357 HH12 2.784 1.882 |
| 6621 | | /E ARG 357 NH2 /opp DT -13 O2 /E ARG 357 HH22 2.882 2.025 |
| 6622 | | /E ARG 357 NH2 /opp DT -13 O4' /E ARG 357 HH22 3.135 2.386 |
| 6623 | | /E GLU 358 N /main DG 15 OP1 /E GLU 358 H 2.888 1.905 |
| 6624 | | /E THR 359 OG1 /opp DG -10 OP1 /E THR 359 HG1 2.802 2.243 |
| 6625 | | /E ARG 362 N /opp DG -10 O3' /E ARG 362 H 3.350 2.344 |
| 6626 | | /E ARG 362 NH1 /opp DT -11 O2 /E ARG 362 HH12 2.975 2.081 |
| 6627 | | /E ARG 362 NH1 /opp DG -10 O4' /E ARG 362 HH11 3.022 2.183 |
| 6628 | | /E ARG 362 NH2 /main DT 12 O2 /E ARG 362 HH22 2.881 2.130 |
| 6629 | | /E ARG 362 NH2 /main DA 13 O4' /E ARG 362 HH21 3.366 2.779 |
| 6630 | | /E LYS 363 N /opp DC -9 OP2 /E LYS 363 H 3.408 2.442 |
| 6631 | | /E LYS 363 NZ /opp DA -8 OP1 /E LYS 363 HZ1 2.944 1.968 |
| 6632 | | /G GLY 543 N /main DA 0 OP1 /G GLY 543 H 2.943 2.343 |
| 6633 | | /G GLY 546 N /main DA 1 OP1 /G GLY 546 H 2.915 2.028 |
| 6634 | | /G LYS 547 NZ /opp DG 2 O3' /G LYS 547 HZ2 2.870 2.326 |
| 6635 | | /G LYS 547 NZ /opp DG 3 OP1 /G LYS 547 HZ1 2.552 1.558 |
| 6636 | | /G LYS 548 NZ /main DA 1 N3 /G LYS 548 HZ1 2.902 2.236 |
| 6637 | | /G LYS 548 NZ /main DG 2 O4' /G LYS 548 HZ2 2.987 2.212 |
| 6638 | | /G LYS 548 NZ /opp DT 0 O2 /G LYS 548 HZ3 3.197 2.248 |
| 6639 | | /G ASN 553 N /opp DG 3 OP2 /G ASN 553 H 2.957 2.079 |
| 6640 | | /G ARG 557 NH1 /opp DG 5 O6 /G ARG 557 HH12 2.913 1.906 |
| 6641 | | /G ARG 557 NH2 /opp DG 5 N7 /G ARG 557 HH22 2.372 1.443 |
| 6642 | | /G LYS 560 NZ /main DA -11 OP1 /G LYS 560 HZ3 3.180 2.601 |
| 6643 | | /G GLY 561 N /main DT -10 OP1 /G GLY 561 H 3.390 2.598 |
| 6644 | | /G GLY 561 N /main DT -10 OP2 /G GLY 561 H 2.846 2.111 |
| 6645 | | /G THR 563 N /main DT -10 OP1 /G THR 563 H 2.931 2.306 |
| 6646 | | /G THR 563 OG1 /main DT -10 OP1 /G THR 563 HG1 3.027 2.078 |
| 6647 | | /G ALA 565 N /main DA -9 OP2 /G ALA 565 H 2.576 1.574 |
| 6648 | | /G ARG 574 NH2 /opp DG 3 OP1 /G ARG 574 HH21 3.076 2.128 |
| 6649 | | /G LYS 581 NZ /main DA 0 O5' /G LYS 581 HZ1 3.367 2.792 |
| 6650 | | /G LYS 581 NZ /main DA 0 OP2 /G LYS 581 HZ1 3.143 2.140 |
| 6651 | | |
| 6652 | | |
| 6653 | | |
| 6654 | | 74 hydrogen bonds found |
| 6655 | | 21 strict hydrogen bonds found |
| 6656 | | |
| 6657 | | > select clear |
| 6658 | | |
| 6659 | | > save "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 6660 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 6661 | | > structures/PDBs/ylODC_54bp-oriC061_complete/new_hbond_ver30.cxs" |
| 6662 | | |
| 6663 | | > select /main:-13 |
| 6664 | | |
| 6665 | | 30 atoms, 31 bonds, 1 residue, 1 model selected |
| 6666 | | |
| 6667 | | > hide sel cartoons |
| 6668 | | |
| 6669 | | > show sel cartoons |
| 6670 | | |
| 6671 | | > select /A:436@ND2 |
| 6672 | | |
| 6673 | | 1 atom, 1 residue, 1 model selected |
| 6674 | | |
| 6675 | | > select /main:-12 |
| 6676 | | |
| 6677 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 6678 | | |
| 6679 | | > select /main:-10 |
| 6680 | | |
| 6681 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 6682 | | |
| 6683 | | > hide sel cartoons |
| 6684 | | |
| 6685 | | > show sel cartoons |
| 6686 | | |
| 6687 | | > select /main:-11 |
| 6688 | | |
| 6689 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 6690 | | |
| 6691 | | > hide sel cartoons |
| 6692 | | |
| 6693 | | > show sel cartoons |
| 6694 | | |
| 6695 | | > select /main:-10 |
| 6696 | | |
| 6697 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 6698 | | |
| 6699 | | > select clear |
| 6700 | | |
| 6701 | | > select /main:-9 |
| 6702 | | |
| 6703 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 6704 | | |
| 6705 | | > select /main:-9 |
| 6706 | | |
| 6707 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 6708 | | |
| 6709 | | > hide sel cartoons |
| 6710 | | |
| 6711 | | > show sel cartoons |
| 6712 | | |
| 6713 | | > select /main:-8 |
| 6714 | | |
| 6715 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 6716 | | |
| 6717 | | > select /main:-9 |
| 6718 | | |
| 6719 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 6720 | | |
| 6721 | | > hide sel cartoons |
| 6722 | | |
| 6723 | | > show sel cartoons |
| 6724 | | |
| 6725 | | > hide sel cartoons |
| 6726 | | |
| 6727 | | > select /main:-8 |
| 6728 | | |
| 6729 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 6730 | | |
| 6731 | | > hide sel cartoons |
| 6732 | | |
| 6733 | | > show sel cartoons |
| 6734 | | |
| 6735 | | > select /main:-9@C3' |
| 6736 | | |
| 6737 | | 1 atom, 1 residue, 1 model selected |
| 6738 | | |
| 6739 | | > select down |
| 6740 | | |
| 6741 | | 1 atom, 1 residue, 1 model selected |
| 6742 | | |
| 6743 | | > select up |
| 6744 | | |
| 6745 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 6746 | | |
| 6747 | | > show sel cartoons |
| 6748 | | |
| 6749 | | > select clear |
| 6750 | | |
| 6751 | | > select /main:0 |
| 6752 | | |
| 6753 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 6754 | | |
| 6755 | | > select /main:0 |
| 6756 | | |
| 6757 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 6758 | | |
| 6759 | | > hide sel cartoons |
| 6760 | | |
| 6761 | | > show sel cartoons |
| 6762 | | |
| 6763 | | > select /main:1 |
| 6764 | | |
| 6765 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 6766 | | |
| 6767 | | > select /main:6 |
| 6768 | | |
| 6769 | | 30 atoms, 31 bonds, 1 residue, 1 model selected |
| 6770 | | |
| 6771 | | > hide sel cartoons |
| 6772 | | |
| 6773 | | > select nucleic |
| 6774 | | |
| 6775 | | 2291 atoms, 2469 bonds, 72 residues, 1 model selected |
| 6776 | | |
| 6777 | | > hbonds sel saveFile "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 6778 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 6779 | | > structures/PDBs/ylODC_54bp-oriC061_complete/hbond-generation2" dashes 6 |
| 6780 | | > restrict #1/A,B,C,D,E,F,G twoColors true intraRes false reveal true |
| 6781 | | > retainCurrent true log true |
| 6782 | | |
| 6783 | | |
| 6784 | | Finding intermodel H-bonds |
| 6785 | | Finding intramodel H-bonds |
| 6786 | | Constraints relaxed by 0.4 angstroms and 20 degrees |
| 6787 | | Models used: |
| 6788 | | 1 ylODC_54bpOriC061_rev30_PostPhenix.pdb |
| 6789 | | |
| 6790 | | 61 H-bonds |
| 6791 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 6792 | | /A ARG 301 NE /opp DC 18 OP1 /A ARG 301 HE 3.042 2.096 |
| 6793 | | /A ARG 301 NH1 /main DT -16 O2 /A ARG 301 HH12 2.780 1.937 |
| 6794 | | /A ARG 301 NH1 /main DC -15 O4' /A ARG 301 HH11 2.808 1.918 |
| 6795 | | /A ARG 301 NH2 /opp DT 17 O2 /A ARG 301 HH22 3.419 2.726 |
| 6796 | | /A ARG 301 NH2 /opp DC 18 OP1 /A ARG 301 HH21 3.241 2.383 |
| 6797 | | /A PHE 303 N /main DC -13 OP1 /A PHE 303 H 2.683 1.713 |
| 6798 | | /A LYS 305 NZ /main DA -12 OP1 /A LYS 305 HZ1 3.005 2.074 |
| 6799 | | /A ASN 435 ND2 /main DC -13 OP2 /A ASN 435 HD22 2.896 1.911 |
| 6800 | | /A ASN 436 ND2 /main DC -13 OP2 /A ASN 436 HD22 3.172 2.251 |
| 6801 | | /B LYS 148 NZ /opp DG -10 OP1 /B LYS 148 HZ3 2.880 2.062 |
| 6802 | | /B ARG 150 NH1 /main DG 9 O6 /B ARG 150 HH12 3.317 2.492 |
| 6803 | | /B ARG 150 NH1 /opp DG -10 O6 /B ARG 150 HH12 3.200 2.518 |
| 6804 | | /B ARG 150 NH2 /main DG 9 O6 /B ARG 150 HH22 2.932 1.954 |
| 6805 | | /B GLY 153 N /main DT 8 OP2 /B GLY 153 H 2.955 1.965 |
| 6806 | | /B LYS 248 NZ /opp DA 8 O3' /B LYS 248 HZ1 3.058 2.307 |
| 6807 | | /B LYS 279 N /opp DA 10 OP1 /B LYS 279 H 3.012 2.176 |
| 6808 | | /B ASP 280 N /opp DA 10 OP1 /B ASP 280 H 3.419 2.439 |
| 6809 | | /C LYS 188 NZ /main DT -8 OP1 /C LYS 188 HZ1 2.597 1.602 |
| 6810 | | /C ARG 219 N /opp DT 12 OP1 /C ARG 219 H 2.860 1.859 |
| 6811 | | /C ARG 219 NH1 /opp DT 11 OP1 /C ARG 219 HH11 2.808 2.044 |
| 6812 | | /C ARG 220 NH1 /main DT -10 O2 /C ARG 220 HH11 3.328 2.600 |
| 6813 | | /C ARG 220 NH1 /opp DT 11 O2 /C ARG 220 HH11 3.062 2.380 |
| 6814 | | /C TYR 223 OH /main DA -9 O3' /C TYR 223 HH 2.926 2.064 |
| 6815 | | /C TYR 607 OH /main DC 6 OP2 /C TYR 607 HH 3.278 2.327 |
| 6816 | | /C ARG 672 N /main DC 6 OP1 /C ARG 672 H 2.895 1.905 |
| 6817 | | /C ARG 672 NH1 /opp DT -4 O2 /C ARG 672 HH12 2.707 1.845 |
| 6818 | | /C ARG 672 NH2 /opp DT -4 O2 /C ARG 672 HH22 3.408 2.771 |
| 6819 | | /C LYS 673 NZ /main DA 7 OP1 /C LYS 673 HZ1 2.886 1.972 |
| 6820 | | /D LYS 168 NZ /main DA -12 N3 /D LYS 168 HZ1 2.838 1.847 |
| 6821 | | /D SER 169 OG /main DA -11 OP2 /D SER 169 HG 2.801 1.842 |
| 6822 | | /D ILE 170 N /main DA -11 OP2 /D ILE 170 H 3.077 2.202 |
| 6823 | | /D SER 463 OG /opp DG 1 OP1 /D SER 463 HG 2.493 1.565 |
| 6824 | | /D LYS 465 NZ /opp DG 2 O6 /D LYS 465 HZ1 2.363 1.498 |
| 6825 | | /D LYS 465 NZ /opp DG 3 O6 /D LYS 465 HZ2 2.546 1.684 |
| 6826 | | /E ARG 76 NH1 /main DA -9 OP1 /E ARG 76 HH11 3.235 2.257 |
| 6827 | | /E ARG 340 NE /opp DG -10 O5' /E ARG 340 HE 3.009 2.192 |
| 6828 | | /E ARG 340 NE /opp DG -10 OP2 /E ARG 340 HE 2.873 1.974 |
| 6829 | | /E ARG 340 NH2 /opp DG -10 OP2 /E ARG 340 HH21 3.300 2.551 |
| 6830 | | /E TYR 341 OH /opp DC -9 OP1 /E TYR 341 HH 2.940 2.219 |
| 6831 | | /E ARG 357 NH1 /opp DT -13 O2 /E ARG 357 HH12 2.784 1.882 |
| 6832 | | /E ARG 357 NH2 /opp DT -13 O2 /E ARG 357 HH22 2.882 2.025 |
| 6833 | | /E ARG 357 NH2 /opp DT -13 O4' /E ARG 357 HH22 3.135 2.386 |
| 6834 | | /E GLU 358 N /main DG 15 OP1 /E GLU 358 H 2.888 1.905 |
| 6835 | | /E THR 359 OG1 /opp DG -10 OP1 /E THR 359 HG1 2.802 2.243 |
| 6836 | | /E ARG 362 N /opp DG -10 O3' /E ARG 362 H 3.350 2.344 |
| 6837 | | /E ARG 362 NH1 /opp DT -11 O2 /E ARG 362 HH12 2.975 2.081 |
| 6838 | | /E ARG 362 NH1 /opp DG -10 O4' /E ARG 362 HH11 3.022 2.183 |
| 6839 | | /E ARG 362 NH2 /main DT 12 O2 /E ARG 362 HH22 2.881 2.130 |
| 6840 | | /E LYS 363 N /opp DC -9 OP2 /E LYS 363 H 3.408 2.442 |
| 6841 | | /E LYS 363 NZ /opp DA -8 OP1 /E LYS 363 HZ1 2.944 1.968 |
| 6842 | | /G GLY 546 N /main DA 1 OP1 /G GLY 546 H 2.915 2.028 |
| 6843 | | /G LYS 547 NZ /opp DG 3 OP1 /G LYS 547 HZ1 2.552 1.558 |
| 6844 | | /G LYS 548 NZ /opp DT 0 O2 /G LYS 548 HZ3 3.197 2.248 |
| 6845 | | /G ASN 553 N /opp DG 3 OP2 /G ASN 553 H 2.957 2.079 |
| 6846 | | /G ARG 557 NH1 /opp DG 5 O6 /G ARG 557 HH12 2.913 1.906 |
| 6847 | | /G ARG 557 NH2 /opp DG 5 N7 /G ARG 557 HH22 2.372 1.443 |
| 6848 | | /G GLY 561 N /main DT -10 OP2 /G GLY 561 H 2.846 2.111 |
| 6849 | | /G THR 563 OG1 /main DT -10 OP1 /G THR 563 HG1 3.027 2.078 |
| 6850 | | /G ALA 565 N /main DA -9 OP2 /G ALA 565 H 2.576 1.574 |
| 6851 | | /G ARG 574 NH2 /opp DG 3 OP1 /G ARG 574 HH21 3.076 2.128 |
| 6852 | | /G LYS 581 NZ /main DA 0 OP2 /G LYS 581 HZ1 3.143 2.140 |
| 6853 | | |
| 6854 | | |
| 6855 | | |
| 6856 | | 61 hydrogen bonds found |
| 6857 | | 21 strict hydrogen bonds found |
| 6858 | | |
| 6859 | | > ui tool show H-Bonds |
| 6860 | | |
| 6861 | | > hbonds sel dashes 6 restrict #1/A,B,C,D,E,F,G twoColors true intraRes false |
| 6862 | | > select true reveal true retainCurrent true log true |
| 6863 | | |
| 6864 | | |
| 6865 | | Finding intermodel H-bonds |
| 6866 | | Finding intramodel H-bonds |
| 6867 | | Constraints relaxed by 0.4 angstroms and 20 degrees |
| 6868 | | Models used: |
| 6869 | | 1 ylODC_54bpOriC061_rev30_PostPhenix.pdb |
| 6870 | | |
| 6871 | | 61 H-bonds |
| 6872 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 6873 | | /A ARG 301 NE /opp DC 18 OP1 /A ARG 301 HE 3.042 2.096 |
| 6874 | | /A ARG 301 NH1 /main DT -16 O2 /A ARG 301 HH12 2.780 1.937 |
| 6875 | | /A ARG 301 NH1 /main DC -15 O4' /A ARG 301 HH11 2.808 1.918 |
| 6876 | | /A ARG 301 NH2 /opp DT 17 O2 /A ARG 301 HH22 3.419 2.726 |
| 6877 | | /A ARG 301 NH2 /opp DC 18 OP1 /A ARG 301 HH21 3.241 2.383 |
| 6878 | | /A PHE 303 N /main DC -13 OP1 /A PHE 303 H 2.683 1.713 |
| 6879 | | /A LYS 305 NZ /main DA -12 OP1 /A LYS 305 HZ1 3.005 2.074 |
| 6880 | | /A ASN 435 ND2 /main DC -13 OP2 /A ASN 435 HD22 2.896 1.911 |
| 6881 | | /A ASN 436 ND2 /main DC -13 OP2 /A ASN 436 HD22 3.172 2.251 |
| 6882 | | /B LYS 148 NZ /opp DG -10 OP1 /B LYS 148 HZ3 2.880 2.062 |
| 6883 | | /B ARG 150 NH1 /main DG 9 O6 /B ARG 150 HH12 3.317 2.492 |
| 6884 | | /B ARG 150 NH1 /opp DG -10 O6 /B ARG 150 HH12 3.200 2.518 |
| 6885 | | /B ARG 150 NH2 /main DG 9 O6 /B ARG 150 HH22 2.932 1.954 |
| 6886 | | /B GLY 153 N /main DT 8 OP2 /B GLY 153 H 2.955 1.965 |
| 6887 | | /B LYS 248 NZ /opp DA 8 O3' /B LYS 248 HZ1 3.058 2.307 |
| 6888 | | /B LYS 279 N /opp DA 10 OP1 /B LYS 279 H 3.012 2.176 |
| 6889 | | /B ASP 280 N /opp DA 10 OP1 /B ASP 280 H 3.419 2.439 |
| 6890 | | /C LYS 188 NZ /main DT -8 OP1 /C LYS 188 HZ1 2.597 1.602 |
| 6891 | | /C ARG 219 N /opp DT 12 OP1 /C ARG 219 H 2.860 1.859 |
| 6892 | | /C ARG 219 NH1 /opp DT 11 OP1 /C ARG 219 HH11 2.808 2.044 |
| 6893 | | /C ARG 220 NH1 /main DT -10 O2 /C ARG 220 HH11 3.328 2.600 |
| 6894 | | /C ARG 220 NH1 /opp DT 11 O2 /C ARG 220 HH11 3.062 2.380 |
| 6895 | | /C TYR 223 OH /main DA -9 O3' /C TYR 223 HH 2.926 2.064 |
| 6896 | | /C TYR 607 OH /main DC 6 OP2 /C TYR 607 HH 3.278 2.327 |
| 6897 | | /C ARG 672 N /main DC 6 OP1 /C ARG 672 H 2.895 1.905 |
| 6898 | | /C ARG 672 NH1 /opp DT -4 O2 /C ARG 672 HH12 2.707 1.845 |
| 6899 | | /C ARG 672 NH2 /opp DT -4 O2 /C ARG 672 HH22 3.408 2.771 |
| 6900 | | /C LYS 673 NZ /main DA 7 OP1 /C LYS 673 HZ1 2.886 1.972 |
| 6901 | | /D LYS 168 NZ /main DA -12 N3 /D LYS 168 HZ1 2.838 1.847 |
| 6902 | | /D SER 169 OG /main DA -11 OP2 /D SER 169 HG 2.801 1.842 |
| 6903 | | /D ILE 170 N /main DA -11 OP2 /D ILE 170 H 3.077 2.202 |
| 6904 | | /D SER 463 OG /opp DG 1 OP1 /D SER 463 HG 2.493 1.565 |
| 6905 | | /D LYS 465 NZ /opp DG 2 O6 /D LYS 465 HZ1 2.363 1.498 |
| 6906 | | /D LYS 465 NZ /opp DG 3 O6 /D LYS 465 HZ2 2.546 1.684 |
| 6907 | | /E ARG 76 NH1 /main DA -9 OP1 /E ARG 76 HH11 3.235 2.257 |
| 6908 | | /E ARG 340 NE /opp DG -10 O5' /E ARG 340 HE 3.009 2.192 |
| 6909 | | /E ARG 340 NE /opp DG -10 OP2 /E ARG 340 HE 2.873 1.974 |
| 6910 | | /E ARG 340 NH2 /opp DG -10 OP2 /E ARG 340 HH21 3.300 2.551 |
| 6911 | | /E TYR 341 OH /opp DC -9 OP1 /E TYR 341 HH 2.940 2.219 |
| 6912 | | /E ARG 357 NH1 /opp DT -13 O2 /E ARG 357 HH12 2.784 1.882 |
| 6913 | | /E ARG 357 NH2 /opp DT -13 O2 /E ARG 357 HH22 2.882 2.025 |
| 6914 | | /E ARG 357 NH2 /opp DT -13 O4' /E ARG 357 HH22 3.135 2.386 |
| 6915 | | /E GLU 358 N /main DG 15 OP1 /E GLU 358 H 2.888 1.905 |
| 6916 | | /E THR 359 OG1 /opp DG -10 OP1 /E THR 359 HG1 2.802 2.243 |
| 6917 | | /E ARG 362 N /opp DG -10 O3' /E ARG 362 H 3.350 2.344 |
| 6918 | | /E ARG 362 NH1 /opp DT -11 O2 /E ARG 362 HH12 2.975 2.081 |
| 6919 | | /E ARG 362 NH1 /opp DG -10 O4' /E ARG 362 HH11 3.022 2.183 |
| 6920 | | /E ARG 362 NH2 /main DT 12 O2 /E ARG 362 HH22 2.881 2.130 |
| 6921 | | /E LYS 363 N /opp DC -9 OP2 /E LYS 363 H 3.408 2.442 |
| 6922 | | /E LYS 363 NZ /opp DA -8 OP1 /E LYS 363 HZ1 2.944 1.968 |
| 6923 | | /G GLY 546 N /main DA 1 OP1 /G GLY 546 H 2.915 2.028 |
| 6924 | | /G LYS 547 NZ /opp DG 3 OP1 /G LYS 547 HZ1 2.552 1.558 |
| 6925 | | /G LYS 548 NZ /opp DT 0 O2 /G LYS 548 HZ3 3.197 2.248 |
| 6926 | | /G ASN 553 N /opp DG 3 OP2 /G ASN 553 H 2.957 2.079 |
| 6927 | | /G ARG 557 NH1 /opp DG 5 O6 /G ARG 557 HH12 2.913 1.906 |
| 6928 | | /G ARG 557 NH2 /opp DG 5 N7 /G ARG 557 HH22 2.372 1.443 |
| 6929 | | /G GLY 561 N /main DT -10 OP2 /G GLY 561 H 2.846 2.111 |
| 6930 | | /G THR 563 OG1 /main DT -10 OP1 /G THR 563 HG1 3.027 2.078 |
| 6931 | | /G ALA 565 N /main DA -9 OP2 /G ALA 565 H 2.576 1.574 |
| 6932 | | /G ARG 574 NH2 /opp DG 3 OP1 /G ARG 574 HH21 3.076 2.128 |
| 6933 | | /G LYS 581 NZ /main DA 0 OP2 /G LYS 581 HZ1 3.143 2.140 |
| 6934 | | |
| 6935 | | |
| 6936 | | |
| 6937 | | 61 hydrogen bonds found |
| 6938 | | 21 strict hydrogen bonds found |
| 6939 | | |
| 6940 | | > select nucleic |
| 6941 | | |
| 6942 | | 2291 atoms, 2469 bonds, 72 residues, 1 model selected |
| 6943 | | |
| 6944 | | > hbonds sel dashes 6 restrict #1/A,B,C,D,E,F,G twoColors true slopColor |
| 6945 | | > #00f900 intraRes false select true reveal true retainCurrent true log true |
| 6946 | | |
| 6947 | | |
| 6948 | | Finding intermodel H-bonds |
| 6949 | | Finding intramodel H-bonds |
| 6950 | | Constraints relaxed by 0.4 angstroms and 20 degrees |
| 6951 | | Models used: |
| 6952 | | 1 ylODC_54bpOriC061_rev30_PostPhenix.pdb |
| 6953 | | |
| 6954 | | 61 H-bonds |
| 6955 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 6956 | | /A ARG 301 NE /opp DC 18 OP1 /A ARG 301 HE 3.042 2.096 |
| 6957 | | /A ARG 301 NH1 /main DT -16 O2 /A ARG 301 HH12 2.780 1.937 |
| 6958 | | /A ARG 301 NH1 /main DC -15 O4' /A ARG 301 HH11 2.808 1.918 |
| 6959 | | /A ARG 301 NH2 /opp DT 17 O2 /A ARG 301 HH22 3.419 2.726 |
| 6960 | | /A ARG 301 NH2 /opp DC 18 OP1 /A ARG 301 HH21 3.241 2.383 |
| 6961 | | /A PHE 303 N /main DC -13 OP1 /A PHE 303 H 2.683 1.713 |
| 6962 | | /A LYS 305 NZ /main DA -12 OP1 /A LYS 305 HZ1 3.005 2.074 |
| 6963 | | /A ASN 435 ND2 /main DC -13 OP2 /A ASN 435 HD22 2.896 1.911 |
| 6964 | | /A ASN 436 ND2 /main DC -13 OP2 /A ASN 436 HD22 3.172 2.251 |
| 6965 | | /B LYS 148 NZ /opp DG -10 OP1 /B LYS 148 HZ3 2.880 2.062 |
| 6966 | | /B ARG 150 NH1 /main DG 9 O6 /B ARG 150 HH12 3.317 2.492 |
| 6967 | | /B ARG 150 NH1 /opp DG -10 O6 /B ARG 150 HH12 3.200 2.518 |
| 6968 | | /B ARG 150 NH2 /main DG 9 O6 /B ARG 150 HH22 2.932 1.954 |
| 6969 | | /B GLY 153 N /main DT 8 OP2 /B GLY 153 H 2.955 1.965 |
| 6970 | | /B LYS 248 NZ /opp DA 8 O3' /B LYS 248 HZ1 3.058 2.307 |
| 6971 | | /B LYS 279 N /opp DA 10 OP1 /B LYS 279 H 3.012 2.176 |
| 6972 | | /B ASP 280 N /opp DA 10 OP1 /B ASP 280 H 3.419 2.439 |
| 6973 | | /C LYS 188 NZ /main DT -8 OP1 /C LYS 188 HZ1 2.597 1.602 |
| 6974 | | /C ARG 219 N /opp DT 12 OP1 /C ARG 219 H 2.860 1.859 |
| 6975 | | /C ARG 219 NH1 /opp DT 11 OP1 /C ARG 219 HH11 2.808 2.044 |
| 6976 | | /C ARG 220 NH1 /main DT -10 O2 /C ARG 220 HH11 3.328 2.600 |
| 6977 | | /C ARG 220 NH1 /opp DT 11 O2 /C ARG 220 HH11 3.062 2.380 |
| 6978 | | /C TYR 223 OH /main DA -9 O3' /C TYR 223 HH 2.926 2.064 |
| 6979 | | /C TYR 607 OH /main DC 6 OP2 /C TYR 607 HH 3.278 2.327 |
| 6980 | | /C ARG 672 N /main DC 6 OP1 /C ARG 672 H 2.895 1.905 |
| 6981 | | /C ARG 672 NH1 /opp DT -4 O2 /C ARG 672 HH12 2.707 1.845 |
| 6982 | | /C ARG 672 NH2 /opp DT -4 O2 /C ARG 672 HH22 3.408 2.771 |
| 6983 | | /C LYS 673 NZ /main DA 7 OP1 /C LYS 673 HZ1 2.886 1.972 |
| 6984 | | /D LYS 168 NZ /main DA -12 N3 /D LYS 168 HZ1 2.838 1.847 |
| 6985 | | /D SER 169 OG /main DA -11 OP2 /D SER 169 HG 2.801 1.842 |
| 6986 | | /D ILE 170 N /main DA -11 OP2 /D ILE 170 H 3.077 2.202 |
| 6987 | | /D SER 463 OG /opp DG 1 OP1 /D SER 463 HG 2.493 1.565 |
| 6988 | | /D LYS 465 NZ /opp DG 2 O6 /D LYS 465 HZ1 2.363 1.498 |
| 6989 | | /D LYS 465 NZ /opp DG 3 O6 /D LYS 465 HZ2 2.546 1.684 |
| 6990 | | /E ARG 76 NH1 /main DA -9 OP1 /E ARG 76 HH11 3.235 2.257 |
| 6991 | | /E ARG 340 NE /opp DG -10 O5' /E ARG 340 HE 3.009 2.192 |
| 6992 | | /E ARG 340 NE /opp DG -10 OP2 /E ARG 340 HE 2.873 1.974 |
| 6993 | | /E ARG 340 NH2 /opp DG -10 OP2 /E ARG 340 HH21 3.300 2.551 |
| 6994 | | /E TYR 341 OH /opp DC -9 OP1 /E TYR 341 HH 2.940 2.219 |
| 6995 | | /E ARG 357 NH1 /opp DT -13 O2 /E ARG 357 HH12 2.784 1.882 |
| 6996 | | /E ARG 357 NH2 /opp DT -13 O2 /E ARG 357 HH22 2.882 2.025 |
| 6997 | | /E ARG 357 NH2 /opp DT -13 O4' /E ARG 357 HH22 3.135 2.386 |
| 6998 | | /E GLU 358 N /main DG 15 OP1 /E GLU 358 H 2.888 1.905 |
| 6999 | | /E THR 359 OG1 /opp DG -10 OP1 /E THR 359 HG1 2.802 2.243 |
| 7000 | | /E ARG 362 N /opp DG -10 O3' /E ARG 362 H 3.350 2.344 |
| 7001 | | /E ARG 362 NH1 /opp DT -11 O2 /E ARG 362 HH12 2.975 2.081 |
| 7002 | | /E ARG 362 NH1 /opp DG -10 O4' /E ARG 362 HH11 3.022 2.183 |
| 7003 | | /E ARG 362 NH2 /main DT 12 O2 /E ARG 362 HH22 2.881 2.130 |
| 7004 | | /E LYS 363 N /opp DC -9 OP2 /E LYS 363 H 3.408 2.442 |
| 7005 | | /E LYS 363 NZ /opp DA -8 OP1 /E LYS 363 HZ1 2.944 1.968 |
| 7006 | | /G GLY 546 N /main DA 1 OP1 /G GLY 546 H 2.915 2.028 |
| 7007 | | /G LYS 547 NZ /opp DG 3 OP1 /G LYS 547 HZ1 2.552 1.558 |
| 7008 | | /G LYS 548 NZ /opp DT 0 O2 /G LYS 548 HZ3 3.197 2.248 |
| 7009 | | /G ASN 553 N /opp DG 3 OP2 /G ASN 553 H 2.957 2.079 |
| 7010 | | /G ARG 557 NH1 /opp DG 5 O6 /G ARG 557 HH12 2.913 1.906 |
| 7011 | | /G ARG 557 NH2 /opp DG 5 N7 /G ARG 557 HH22 2.372 1.443 |
| 7012 | | /G GLY 561 N /main DT -10 OP2 /G GLY 561 H 2.846 2.111 |
| 7013 | | /G THR 563 OG1 /main DT -10 OP1 /G THR 563 HG1 3.027 2.078 |
| 7014 | | /G ALA 565 N /main DA -9 OP2 /G ALA 565 H 2.576 1.574 |
| 7015 | | /G ARG 574 NH2 /opp DG 3 OP1 /G ARG 574 HH21 3.076 2.128 |
| 7016 | | /G LYS 581 NZ /main DA 0 OP2 /G LYS 581 HZ1 3.143 2.140 |
| 7017 | | |
| 7018 | | |
| 7019 | | |
| 7020 | | 61 hydrogen bonds found |
| 7021 | | 21 strict hydrogen bonds found |
| 7022 | | |
| 7023 | | > select clear |
| 7024 | | |
| 7025 | | > select /main:7 |
| 7026 | | |
| 7027 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 7028 | | |
| 7029 | | > hide sel cartoons |
| 7030 | | |
| 7031 | | > show sel cartoons |
| 7032 | | |
| 7033 | | > select /main:8 |
| 7034 | | |
| 7035 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 7036 | | |
| 7037 | | > hide sel cartoons |
| 7038 | | |
| 7039 | | > show sel cartoons |
| 7040 | | |
| 7041 | | > select clear |
| 7042 | | |
| 7043 | | > select /main:12@C2 |
| 7044 | | |
| 7045 | | 1 atom, 1 residue, 1 model selected |
| 7046 | | |
| 7047 | | > select /main:15 |
| 7048 | | |
| 7049 | | 33 atoms, 35 bonds, 1 residue, 1 model selected |
| 7050 | | |
| 7051 | | > select clear |
| 7052 | | |
| 7053 | | > select /opp:17 |
| 7054 | | |
| 7055 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 7056 | | |
| 7057 | | > select /opp:18 |
| 7058 | | |
| 7059 | | 31 atoms, 32 bonds, 1 residue, 1 model selected |
| 7060 | | |
| 7061 | | > select /opp:18 |
| 7062 | | |
| 7063 | | 31 atoms, 32 bonds, 1 residue, 1 model selected |
| 7064 | | |
| 7065 | | > select /opp:17 |
| 7066 | | |
| 7067 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 7068 | | |
| 7069 | | > select /opp:18 |
| 7070 | | |
| 7071 | | 31 atoms, 32 bonds, 1 residue, 1 model selected |
| 7072 | | |
| 7073 | | > hide sel cartoons |
| 7074 | | |
| 7075 | | > show sel cartoons |
| 7076 | | |
| 7077 | | > hide sel cartoons |
| 7078 | | |
| 7079 | | > select /opp:11 |
| 7080 | | |
| 7081 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 7082 | | |
| 7083 | | > hide sel cartoons |
| 7084 | | |
| 7085 | | > show sel cartoons |
| 7086 | | |
| 7087 | | > select clear |
| 7088 | | |
| 7089 | | > select /opp:12 |
| 7090 | | |
| 7091 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 7092 | | |
| 7093 | | > hide sel cartoons |
| 7094 | | |
| 7095 | | > show sel cartoons |
| 7096 | | |
| 7097 | | > select /opp:10 |
| 7098 | | |
| 7099 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 7100 | | |
| 7101 | | > hide sel cartoons |
| 7102 | | |
| 7103 | | > select /opp:9 |
| 7104 | | |
| 7105 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 7106 | | |
| 7107 | | > hide sel cartoons |
| 7108 | | |
| 7109 | | > show sel cartoons |
| 7110 | | |
| 7111 | | > select /opp:8 |
| 7112 | | |
| 7113 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 7114 | | |
| 7115 | | > hide sel cartoons |
| 7116 | | |
| 7117 | | > select /opp:9 |
| 7118 | | |
| 7119 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 7120 | | |
| 7121 | | > select /opp:1 |
| 7122 | | |
| 7123 | | 33 atoms, 35 bonds, 1 residue, 1 model selected |
| 7124 | | |
| 7125 | | > hide sel cartoons |
| 7126 | | |
| 7127 | | > show sel cartoons |
| 7128 | | |
| 7129 | | > select /opp:0 |
| 7130 | | |
| 7131 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 7132 | | |
| 7133 | | > select /opp:-2 |
| 7134 | | |
| 7135 | | 30 atoms, 31 bonds, 1 residue, 1 model selected |
| 7136 | | |
| 7137 | | > select /opp:-4 |
| 7138 | | |
| 7139 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 7140 | | |
| 7141 | | > select /opp:-8 |
| 7142 | | |
| 7143 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 7144 | | |
| 7145 | | > select /opp:-9 |
| 7146 | | |
| 7147 | | 30 atoms, 31 bonds, 1 residue, 1 model selected |
| 7148 | | |
| 7149 | | > hide sel cartoons |
| 7150 | | |
| 7151 | | > show sel cartoons |
| 7152 | | |
| 7153 | | > select /E:363@N |
| 7154 | | |
| 7155 | | 1 atom, 1 residue, 1 model selected |
| 7156 | | |
| 7157 | | > select /opp:-9 |
| 7158 | | |
| 7159 | | 30 atoms, 31 bonds, 1 residue, 1 model selected |
| 7160 | | |
| 7161 | | > select /E:362@N |
| 7162 | | |
| 7163 | | 1 atom, 1 residue, 1 model selected |
| 7164 | | |
| 7165 | | > select /opp:-9 |
| 7166 | | |
| 7167 | | 30 atoms, 31 bonds, 1 residue, 1 model selected |
| 7168 | | |
| 7169 | | > hide sel cartoons |
| 7170 | | |
| 7171 | | > select /opp:-11 |
| 7172 | | |
| 7173 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 7174 | | |
| 7175 | | > hide sel cartoons |
| 7176 | | |
| 7177 | | > select /opp:-10 |
| 7178 | | |
| 7179 | | 33 atoms, 35 bonds, 1 residue, 1 model selected |
| 7180 | | |
| 7181 | | > select /E:357@N |
| 7182 | | |
| 7183 | | 1 atom, 1 residue, 1 model selected |
| 7184 | | |
| 7185 | | > select /E:356 |
| 7186 | | |
| 7187 | | 24 atoms, 23 bonds, 1 residue, 1 model selected |
| 7188 | | |
| 7189 | | > show sel atoms |
| 7190 | | |
| 7191 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 7192 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 7193 | | > structures/PDBs/ylODC_54bp- |
| 7194 | | > oriC061_complete/ylODC_54bpOriC061_rev31_PostPhenix.pdb" |
| 7195 | | |
| 7196 | | Chain information for ylODC_54bpOriC061_rev31_PostPhenix.pdb #2 |
| 7197 | | --- |
| 7198 | | Chain | Description |
| 7199 | | A | No description available |
| 7200 | | B | No description available |
| 7201 | | C | No description available |
| 7202 | | D | No description available |
| 7203 | | E | No description available |
| 7204 | | F | No description available |
| 7205 | | G | No description available |
| 7206 | | H | No description available |
| 7207 | | I | No description available |
| 7208 | | |
| 7209 | | |
| 7210 | | > modelfix |
| 7211 | | |
| 7212 | | Changed 75323 atom styles |
| 7213 | | 71260 atoms, 72152 bonds, 18 pseudobonds, 5940 residues, 4 models selected |
| 7214 | | |
| 7215 | | > close #1 |
| 7216 | | |
| 7217 | | > select nucleic |
| 7218 | | |
| 7219 | | 1476 atoms, 1654 bonds, 72 residues, 1 model selected |
| 7220 | | |
| 7221 | | > hbonds sel saveFile "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 7222 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 7223 | | > structures/PDBs/ylODC_54bp-oriC061_complete/hbond- |
| 7224 | | > generation2_ver31_relaxed40" dashes 6 restrict #2/A,B,C,D,E,F,G angleSlop |
| 7225 | | > 40.0 twoColors true slopColor #ff9300 intraRes false select true reveal true |
| 7226 | | > retainCurrent true log true |
| 7227 | | |
| 7228 | | |
| 7229 | | Finding intermodel H-bonds |
| 7230 | | Finding intramodel H-bonds |
| 7231 | | Constraints relaxed by 0.4 angstroms and 40 degrees |
| 7232 | | Models used: |
| 7233 | | 2 ylODC_54bpOriC061_rev31_PostPhenix.pdb |
| 7234 | | |
| 7235 | | 78 H-bonds |
| 7236 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 7237 | | /A ARG 301 NE /I DC 47 OP1 no hydrogen 3.042 N/A |
| 7238 | | /A ARG 301 NH1 /H DT 10 O2 no hydrogen 2.780 N/A |
| 7239 | | /A ARG 301 NH1 /H DC 11 O4' no hydrogen 2.808 N/A |
| 7240 | | /A ARG 301 NH2 /I DT 46 O2 no hydrogen 3.419 N/A |
| 7241 | | /A ARG 301 NH2 /I DC 47 OP1 no hydrogen 3.241 N/A |
| 7242 | | /A PHE 303 N /H DC 13 OP1 no hydrogen 2.683 N/A |
| 7243 | | /A LYS 305 NZ /H DA 14 OP1 no hydrogen 3.005 N/A |
| 7244 | | /A ASN 435 ND2 /H DC 13 OP2 no hydrogen 2.896 N/A |
| 7245 | | /A ASN 436 ND2 /H DC 13 OP2 no hydrogen 3.172 N/A |
| 7246 | | /B LYS 148 NZ /I DG 19 OP1 no hydrogen 2.880 N/A |
| 7247 | | /B ARG 150 NH1 /H DG 35 O6 no hydrogen 3.317 N/A |
| 7248 | | /B ARG 150 NH1 /I DG 19 O6 no hydrogen 3.200 N/A |
| 7249 | | /B ARG 150 NH2 /H DG 35 O6 no hydrogen 2.932 N/A |
| 7250 | | /B GLY 153 N /H DT 34 OP2 no hydrogen 2.955 N/A |
| 7251 | | /B LYS 248 NZ /I DA 37 O3' no hydrogen 3.058 N/A |
| 7252 | | /B LYS 279 N /I DA 39 OP1 no hydrogen 3.012 N/A |
| 7253 | | /B ASP 280 N /I DA 39 OP1 no hydrogen 3.419 N/A |
| 7254 | | /C LYS 188 NZ /H DT 18 OP1 no hydrogen 2.597 N/A |
| 7255 | | /C ARG 219 N /I DT 41 OP1 no hydrogen 2.860 N/A |
| 7256 | | /C ARG 219 NH1 /I DT 40 OP1 no hydrogen 2.808 N/A |
| 7257 | | /C ARG 220 NH1 /H DA 15 N3 no hydrogen 3.522 N/A |
| 7258 | | /C ARG 220 NH1 /H DT 16 O2 no hydrogen 3.328 N/A |
| 7259 | | /C ARG 220 NH1 /I DT 40 O2 no hydrogen 3.062 N/A |
| 7260 | | /C TYR 223 OH /H DA 17 O3' no hydrogen 2.926 N/A |
| 7261 | | /C TYR 223 OH /H DT 18 OP1 no hydrogen 2.834 N/A |
| 7262 | | /C TYR 607 OH /H DC 32 OP2 no hydrogen 3.278 N/A |
| 7263 | | /C LYS 671 N /H DC 32 OP1 no hydrogen 2.864 N/A |
| 7264 | | /C ARG 672 N /H DC 32 OP1 no hydrogen 2.895 N/A |
| 7265 | | /C ARG 672 NH1 /I DT 25 O2 no hydrogen 2.707 N/A |
| 7266 | | /C ARG 672 NH2 /I DT 25 O2 no hydrogen 3.408 N/A |
| 7267 | | /C LYS 673 NZ /H DA 33 OP1 no hydrogen 2.886 N/A |
| 7268 | | /D LYS 168 NZ /H DA 14 N3 no hydrogen 2.838 N/A |
| 7269 | | /D SER 169 OG /H DA 14 O3' no hydrogen 3.382 N/A |
| 7270 | | /D SER 169 OG /H DA 15 OP2 no hydrogen 2.801 N/A |
| 7271 | | /D ILE 170 N /H DA 15 OP2 no hydrogen 3.077 N/A |
| 7272 | | /D SER 463 OG /I DG 30 OP1 no hydrogen 2.493 N/A |
| 7273 | | /D LYS 465 NZ /I DG 31 N7 no hydrogen 3.444 N/A |
| 7274 | | /D LYS 465 NZ /I DG 31 O6 no hydrogen 2.363 N/A |
| 7275 | | /D LYS 465 NZ /I DG 32 O6 no hydrogen 2.546 N/A |
| 7276 | | /E ARG 76 NH1 /H DA 17 OP1 no hydrogen 3.235 N/A |
| 7277 | | /E ARG 340 NE /I DG 19 O5' no hydrogen 3.009 N/A |
| 7278 | | /E ARG 340 NE /I DG 19 OP2 no hydrogen 2.873 N/A |
| 7279 | | /E ARG 340 NH2 /I DG 19 OP2 no hydrogen 3.300 N/A |
| 7280 | | /E TYR 341 OH /I DG 19 O3' no hydrogen 3.180 N/A |
| 7281 | | /E TYR 341 OH /I DC 20 OP1 no hydrogen 2.940 N/A |
| 7282 | | /E ARG 356 NH1 /I DT 18 OP2 no hydrogen 2.602 N/A |
| 7283 | | /E ARG 357 NH1 /I DT 16 O2 no hydrogen 2.784 N/A |
| 7284 | | /E ARG 357 NH2 /I DT 16 O2 no hydrogen 2.882 N/A |
| 7285 | | /E ARG 357 NH2 /I DT 16 O4' no hydrogen 3.135 N/A |
| 7286 | | /E GLU 358 N /H DG 41 OP1 no hydrogen 2.888 N/A |
| 7287 | | /E THR 359 OG1 /I DG 19 OP1 no hydrogen 2.802 N/A |
| 7288 | | /E ARG 362 N /I DG 19 O3' no hydrogen 3.350 N/A |
| 7289 | | /E ARG 362 NH1 /I DT 18 O2 no hydrogen 2.975 N/A |
| 7290 | | /E ARG 362 NH1 /I DG 19 O4' no hydrogen 3.022 N/A |
| 7291 | | /E ARG 362 NH2 /H DT 38 O2 no hydrogen 2.881 N/A |
| 7292 | | /E ARG 362 NH2 /H DA 39 O4' no hydrogen 3.366 N/A |
| 7293 | | /E LYS 363 N /I DC 20 OP2 no hydrogen 3.408 N/A |
| 7294 | | /E LYS 363 NZ /I DA 21 OP1 no hydrogen 2.944 N/A |
| 7295 | | /G GLY 543 N /H DA 26 OP1 no hydrogen 2.943 N/A |
| 7296 | | /G GLY 546 N /H DA 27 OP1 no hydrogen 2.915 N/A |
| 7297 | | /G LYS 547 NZ /I DG 31 O3' no hydrogen 2.870 N/A |
| 7298 | | /G LYS 547 NZ /I DG 32 OP1 no hydrogen 2.552 N/A |
| 7299 | | /G LYS 548 NZ /H DA 27 N3 no hydrogen 2.902 N/A |
| 7300 | | /G LYS 548 NZ /H DG 28 O4' no hydrogen 2.987 N/A |
| 7301 | | /G LYS 548 NZ /I DT 29 O2 no hydrogen 3.197 N/A |
| 7302 | | /G ASN 553 N /I DG 32 OP2 no hydrogen 2.957 N/A |
| 7303 | | /G ARG 557 NH1 /I DG 34 O6 no hydrogen 2.913 N/A |
| 7304 | | /G ARG 557 NH1 /I DT 35 O4 no hydrogen 3.519 N/A |
| 7305 | | /G ARG 557 NH2 /I DG 34 N7 no hydrogen 2.372 N/A |
| 7306 | | /G LYS 560 NZ /H DA 15 OP1 no hydrogen 3.180 N/A |
| 7307 | | /G GLY 561 N /H DT 16 OP2 no hydrogen 2.846 N/A |
| 7308 | | /G THR 563 N /H DT 16 OP1 no hydrogen 2.931 N/A |
| 7309 | | /G THR 563 OG1 /H DA 15 O3' no hydrogen 2.798 N/A |
| 7310 | | /G THR 563 OG1 /H DT 16 OP1 no hydrogen 3.027 N/A |
| 7311 | | /G ALA 565 N /H DA 17 OP2 no hydrogen 2.576 N/A |
| 7312 | | /G ARG 574 NH2 /I DG 32 OP1 no hydrogen 3.076 N/A |
| 7313 | | /G LYS 581 NZ /H DA 26 O5' no hydrogen 3.367 N/A |
| 7314 | | /G LYS 581 NZ /H DA 26 OP2 no hydrogen 3.143 N/A |
| 7315 | | |
| 7316 | | |
| 7317 | | |
| 7318 | | 78 hydrogen bonds found |
| 7319 | | 25 strict hydrogen bonds found |
| 7320 | | |
| 7321 | | > select up |
| 7322 | | |
| 7323 | | 1142 atoms, 1192 bonds, 81 residues, 1 model selected |
| 7324 | | |
| 7325 | | > show sel atoms |
| 7326 | | |
| 7327 | | > ui tool show H-Bonds |
| 7328 | | |
| 7329 | | > ui tool show "Add Hydrogens" |
| 7330 | | |
| 7331 | | > addh #!2 |
| 7332 | | |
| 7333 | | Summary of feedback from adding hydrogens to |
| 7334 | | ylODC_54bpOriC061_rev31_PostPhenix.pdb #2 |
| 7335 | | --- |
| 7336 | | warnings | Not adding hydrogens to /H DG 8 P because it is missing heavy-atom bond partners |
| 7337 | | Not adding hydrogens to /I DG 13 P because it is missing heavy-atom bond |
| 7338 | | partners |
| 7339 | | notes | Termini for ylODC_54bpOriC061_rev31_PostPhenix.pdb (#2) chain A determined from SEQRES records |
| 7340 | | Termini for ylODC_54bpOriC061_rev31_PostPhenix.pdb (#2) chain B determined |
| 7341 | | from SEQRES records |
| 7342 | | No usable SEQRES records for ylODC_54bpOriC061_rev31_PostPhenix.pdb (#2) chain |
| 7343 | | C; guessing termini instead |
| 7344 | | No usable SEQRES records for ylODC_54bpOriC061_rev31_PostPhenix.pdb (#2) chain |
| 7345 | | D; guessing termini instead |
| 7346 | | No usable SEQRES records for ylODC_54bpOriC061_rev31_PostPhenix.pdb (#2) chain |
| 7347 | | E; guessing termini instead |
| 7348 | | No usable SEQRES records for ylODC_54bpOriC061_rev31_PostPhenix.pdb (#2) chain |
| 7349 | | F; guessing termini instead |
| 7350 | | No usable SEQRES records for ylODC_54bpOriC061_rev31_PostPhenix.pdb (#2) chain |
| 7351 | | G; guessing termini instead |
| 7352 | | Termini for ylODC_54bpOriC061_rev31_PostPhenix.pdb (#2) chain H determined |
| 7353 | | from SEQRES records |
| 7354 | | Termini for ylODC_54bpOriC061_rev31_PostPhenix.pdb (#2) chain I determined |
| 7355 | | from SEQRES records |
| 7356 | | Chain-initial residues that are actual N termini: /A PRO 299, /B PRO 106, /C |
| 7357 | | THR 6, /D VAL 34, /E MET 1, /F PRO 179, /G PRO 93, /C THR 6, /C ASN 72, /D VAL |
| 7358 | | 34, /D GLN 127, /D LEU 296, /D PHE 436, /E MET 1, /E ASP 319, /F PRO 179, /F |
| 7359 | | GLY 316, /G PRO 93, /G ALA 213, /G THR 386, /G VAL 439 |
| 7360 | | Chain-initial residues that are not actual N termini: /C ASN 72, /D GLN 127, |
| 7361 | | /D LEU 296, /D PHE 436, /E ASP 319, /F GLY 316, /G ALA 213, /G THR 386, /G VAL |
| 7362 | | 439 |
| 7363 | | Chain-final residues that are actual C termini: /A LEU 718, /B LEU 507, /C LEU |
| 7364 | | 685, /D ARG 511, /C ARG 29, /C LEU 685, /D SER 123, /D MET 285, /D LEU 420, /D |
| 7365 | | ARG 511, /E MET 300, /E ASN 464, /F THR 307, /F LYS 349, /G GLY 207, /G HIS |
| 7366 | | 335, /G ASN 434, /G LYS 602 |
| 7367 | | Chain-final residues that are not actual C termini: /C ARG 29, /D SER 123, /D |
| 7368 | | MET 285, /D LEU 420, /E ASN 464, /E MET 300, /F LYS 349, /F THR 307, /G LYS |
| 7369 | | 602, /G GLY 207, /G HIS 335, /G ASN 434 |
| 7370 | | Chain-initial residues that are not actual 5' termini: /I DG 13 |
| 7371 | | Missing OXT added to C-terminal residue /B LEU 507 |
| 7372 | | Missing OXT added to C-terminal residue /C ARG 29 |
| 7373 | | Missing OXT added to C-terminal residue /D SER 123 |
| 7374 | | Missing OXT added to C-terminal residue /D MET 285 |
| 7375 | | Missing OXT added to C-terminal residue /D LEU 420 |
| 7376 | | 8 messages similar to the above omitted |
| 7377 | | 3054 hydrogen bonds |
| 7378 | | Adding 'H' to /C ASN 72 |
| 7379 | | Adding 'H' to /D GLN 127 |
| 7380 | | Adding 'H' to /D LEU 296 |
| 7381 | | Adding 'H' to /D PHE 436 |
| 7382 | | Adding 'H' to /E ASP 319 |
| 7383 | | 4 messages similar to the above omitted |
| 7384 | | 24712 hydrogens added |
| 7385 | | |
| 7386 | | |
| 7387 | | > hbonds sel saveFile "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 7388 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 7389 | | > structures/PDBs/ylODC_54bp-oriC061_complete/hbond- |
| 7390 | | > generation2_ver31_relaxed40" restrict #2/A,B,C,D,E,F,G angleSlop 40.0 |
| 7391 | | > twoColors true slopColor #ff9300 intraRes false select true reveal true log |
| 7392 | | > true |
| 7393 | | |
| 7394 | | |
| 7395 | | Finding intermodel H-bonds |
| 7396 | | Finding intramodel H-bonds |
| 7397 | | Constraints relaxed by 0.4 angstroms and 40 degrees |
| 7398 | | Models used: |
| 7399 | | 2 ylODC_54bpOriC061_rev31_PostPhenix.pdb |
| 7400 | | |
| 7401 | | 139 H-bonds |
| 7402 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 7403 | | /A LYS 300 NZ /A ASN 436 OD1 /A LYS 300 HZ1 3.118 2.399 |
| 7404 | | /A ARG 301 NE /I DC 47 OP1 /A ARG 301 HE 3.042 2.096 |
| 7405 | | /A ARG 301 NH1 /H DT 10 O2 /A ARG 301 HH12 2.780 1.937 |
| 7406 | | /A ARG 301 NH1 /H DC 11 O4' /A ARG 301 HH11 2.808 1.918 |
| 7407 | | /A ARG 301 NH2 /I DT 46 O2 /A ARG 301 HH22 3.419 2.726 |
| 7408 | | /A ARG 301 NH2 /I DC 47 OP1 /A ARG 301 HH21 3.241 2.383 |
| 7409 | | /A PHE 303 N /H DC 13 OP1 /A PHE 303 H 2.683 1.713 |
| 7410 | | /A LYS 305 N /A ARG 431 O /A LYS 305 H 2.798 1.912 |
| 7411 | | /A LYS 305 NZ /A GLU 421 OE1 /A LYS 305 HZ2 3.041 2.143 |
| 7412 | | /A LYS 305 NZ /H DA 14 OP1 /A LYS 305 HZ1 3.005 2.074 |
| 7413 | | /A ASN 435 ND2 /A ASN 436 OD1 /A ASN 435 HD21 3.103 2.697 |
| 7414 | | /A ASN 435 ND2 /H DC 13 OP2 /A ASN 435 HD22 2.896 1.911 |
| 7415 | | /A ASN 436 ND2 /H DC 13 OP2 /A ASN 436 HD22 3.172 2.251 |
| 7416 | | /A LYS 439 N /A ASN 435 O /A LYS 439 H 3.001 2.009 |
| 7417 | | /A LEU 440 N /A ASN 436 O /A LEU 440 H 2.894 1.926 |
| 7418 | | /A ARG 696 NH2 /G GLY 546 O /A ARG 696 HH21 3.117 2.584 |
| 7419 | | /B LYS 148 N /B PHE 144 O /B LYS 148 H 2.920 2.035 |
| 7420 | | /B LYS 148 NZ /E ARG 340 O /B LYS 148 HZ1 2.840 1.919 |
| 7421 | | /B LYS 148 NZ /I DG 19 OP1 /B LYS 148 HZ3 2.880 2.062 |
| 7422 | | /B ARG 150 NH1 /H DG 35 O6 /B ARG 150 HH12 3.317 2.492 |
| 7423 | | /B ARG 150 NH1 /I DG 19 O6 /B ARG 150 HH12 3.200 2.518 |
| 7424 | | /B ARG 150 NH2 /H DG 35 O6 /B ARG 150 HH22 2.932 1.954 |
| 7425 | | /B GLY 153 N /H DT 34 OP2 /B GLY 153 H 2.955 1.965 |
| 7426 | | /B LYS 248 NZ /I DA 37 O3' /B LYS 248 HZ1 3.058 2.307 |
| 7427 | | /B ASN 252 N /B LYS 248 O /B ASN 252 H 2.859 1.943 |
| 7428 | | /B ASN 252 ND2 /B LYS 248 O /B ASN 252 HD21 2.823 2.421 |
| 7429 | | /B LYS 279 N /I DA 39 OP1 /B LYS 279 H 3.012 2.176 |
| 7430 | | /B LYS 279 NZ /B ASN 275 O /B LYS 279 HZ1 3.083 2.418 |
| 7431 | | /B ASP 280 N /I DA 39 OP1 /B ASP 280 H 3.419 2.439 |
| 7432 | | /B ASP 282 N /B ASP 280 OD1 /B ASP 282 H 3.192 2.326 |
| 7433 | | /B LEU 284 N /B ASP 280 O /B LEU 284 H 2.837 1.850 |
| 7434 | | /C LYS 188 N /C SER 186 OG /C LYS 188 H 3.325 2.447 |
| 7435 | | /C LYS 188 NZ /H DT 18 OP1 /C LYS 188 HZ1 2.597 1.602 |
| 7436 | | /C LYS 192 N /C LYS 188 O /C LYS 192 H 2.878 1.920 |
| 7437 | | /C ARG 219 N /I DT 41 OP1 /C ARG 219 H 2.860 1.859 |
| 7438 | | /C ARG 219 NE /C GLU 212 OE1 /C ARG 219 HE 3.259 2.637 |
| 7439 | | /C ARG 219 NE /C GLU 212 OE2 /C ARG 219 HE 2.841 2.024 |
| 7440 | | /C ARG 219 NH1 /I DT 40 OP1 /C ARG 219 HH11 2.808 2.044 |
| 7441 | | /C ARG 219 NH2 /C GLU 212 OE1 /C ARG 219 HH21 2.795 2.099 |
| 7442 | | /C ARG 220 N /C ASP 218 OD1 /C ARG 220 H 2.980 2.018 |
| 7443 | | /C ARG 220 NE /C ASP 218 OD1 /C ARG 220 HE 2.810 1.851 |
| 7444 | | /C ARG 220 NH1 /H DA 15 N3 /C ARG 220 HH12 3.522 2.929 |
| 7445 | | /C ARG 220 NH1 /H DT 16 O2 /C ARG 220 HH11 3.328 2.600 |
| 7446 | | /C ARG 220 NH1 /I DT 40 O2 /C ARG 220 HH11 3.062 2.380 |
| 7447 | | /C ARG 220 NH2 /C ASP 218 OD2 /C ARG 220 HH21 2.856 1.862 |
| 7448 | | /C LYS 222 N /C ARG 219 O /C LYS 222 H 3.430 2.524 |
| 7449 | | /C TYR 223 OH /H DA 17 O3' /C TYR 223 HH 2.926 2.064 |
| 7450 | | /C TYR 607 OH /H DC 32 OP2 /C TYR 607 HH 3.278 2.327 |
| 7451 | | /C THR 670 OG1 /C LYS 673 O /C THR 670 HG1 2.628 1.854 |
| 7452 | | /C LYS 671 N /H DC 32 OP1 /C LYS 671 H 2.864 2.159 |
| 7453 | | /C ARG 672 N /H DC 32 OP1 /C ARG 672 H 2.895 1.905 |
| 7454 | | /C ARG 672 NH1 /I DT 25 O2 /C ARG 672 HH12 2.707 1.845 |
| 7455 | | /C ARG 672 NH2 /I DT 25 O2 /C ARG 672 HH22 3.408 2.771 |
| 7456 | | /C LYS 673 NZ /B ARG 152 O /C LYS 673 HZ3 3.238 2.551 |
| 7457 | | /C LYS 673 NZ /H DA 33 OP1 /C LYS 673 HZ1 2.886 1.972 |
| 7458 | | /C SER 676 N /C LYS 673 O /C SER 676 H 3.091 2.178 |
| 7459 | | /D LYS 144 NZ /G LYS 560 O /D LYS 144 HZ1 3.005 2.080 |
| 7460 | | /D ARG 148 NE /G GLY 561 O /D ARG 148 HE 3.310 2.528 |
| 7461 | | /D ARG 148 NH1 /D LYS 168 O /D ARG 148 HH12 2.488 1.669 |
| 7462 | | /D ARG 148 NH2 /D LYS 168 O /D ARG 148 HH22 2.570 1.792 |
| 7463 | | /D ARG 148 NH2 /G GLY 561 O /D ARG 148 HH21 2.721 1.730 |
| 7464 | | /D LYS 168 NZ /H DA 14 N3 /D LYS 168 HZ1 2.838 1.847 |
| 7465 | | /D SER 169 N /D ASN 167 OD1 /D SER 169 H 3.368 2.513 |
| 7466 | | /D SER 169 OG /H DA 14 O3' /D SER 169 HG 3.382 2.801 |
| 7467 | | /D SER 169 OG /H DA 15 OP2 /D SER 169 HG 2.801 1.842 |
| 7468 | | /D ILE 170 N /H DA 15 OP2 /D ILE 170 H 3.077 2.202 |
| 7469 | | /D THR 173 N /D SER 169 O /D THR 173 H 2.884 1.953 |
| 7470 | | /D THR 173 OG1 /D SER 169 O /D THR 173 HG1 2.830 1.908 |
| 7471 | | /D LEU 174 N /D ILE 170 O /D LEU 174 H 2.877 1.880 |
| 7472 | | /D SER 463 OG /I DG 30 OP1 /D SER 463 HG 2.493 1.565 |
| 7473 | | /D LYS 465 NZ /I DG 31 N7 /D LYS 465 HZ1 3.444 2.853 |
| 7474 | | /D LYS 465 NZ /I DG 31 O6 /D LYS 465 HZ1 2.363 1.498 |
| 7475 | | /D LYS 465 NZ /I DG 32 O6 /D LYS 465 HZ2 2.546 1.684 |
| 7476 | | /D ARG 466 N /D SER 463 O /D ARG 466 H 2.968 2.378 |
| 7477 | | /D ARG 466 N /D SER 463 OG /D ARG 466 H 3.160 2.176 |
| 7478 | | /D VAL 467 N /D SER 463 O /D VAL 467 H 2.848 1.922 |
| 7479 | | /D ALA 468 N /D LYS 465 O /D ALA 468 H 3.107 2.545 |
| 7480 | | /D LYS 469 N /D LYS 465 O /D LYS 469 H 3.084 2.242 |
| 7481 | | /E ARG 76 NE /E GLN 80 OE1 /E ARG 76 HE 2.849 1.855 |
| 7482 | | /E ARG 76 NH1 /H DA 17 OP1 /E ARG 76 HH11 3.235 2.257 |
| 7483 | | /E ARG 76 NH2 /C ASP 218 OD2 /E ARG 76 HH22 3.505 2.561 |
| 7484 | | /E ARG 76 NH2 /E GLN 80 OE1 /E ARG 76 HH21 3.522 2.773 |
| 7485 | | /E GLN 80 N /E ARG 76 O /E GLN 80 H 2.915 1.931 |
| 7486 | | /E ARG 340 NE /I DG 19 O5' /E ARG 340 HE 3.009 2.192 |
| 7487 | | /E ARG 340 NE /I DG 19 OP2 /E ARG 340 HE 2.873 1.974 |
| 7488 | | /E ARG 340 NH2 /I DG 19 OP2 /E ARG 340 HH21 3.300 2.551 |
| 7489 | | /E TYR 341 N /E PRO 338 O /E TYR 341 H 3.454 2.618 |
| 7490 | | /E TYR 341 OH /I DC 20 OP1 /E TYR 341 HH 2.940 2.219 |
| 7491 | | /E ARG 344 N /E TYR 341 O /E ARG 344 H 2.933 2.330 |
| 7492 | | /E ARG 344 NH1 /E THR 359 O /E ARG 344 HH11 3.312 2.421 |
| 7493 | | /E PHE 345 N /E TYR 341 O /E PHE 345 H 3.133 2.333 |
| 7494 | | /E LYS 350 NZ /E GLU 358 OE2 /E LYS 350 HZ1 2.768 1.940 |
| 7495 | | /E ARG 356 NE /B ASP 145 OD1 /E ARG 356 HE 2.892 2.039 |
| 7496 | | /E ARG 356 NH1 /I DT 18 OP2 /E ARG 356 HH11 2.602 1.912 |
| 7497 | | /E ARG 356 NH2 /B ASP 145 O /E ARG 356 HH21 2.568 1.841 |
| 7498 | | /E ARG 356 NH2 /B ASP 145 OD1 /E ARG 356 HH21 3.006 2.208 |
| 7499 | | /E ARG 356 NH2 /B THR 149 OG1 /E ARG 356 HH22 3.252 2.468 |
| 7500 | | /E ARG 357 NH1 /I DT 16 O2 /E ARG 357 HH12 2.784 1.882 |
| 7501 | | /E ARG 357 NH2 /I DT 16 O2 /E ARG 357 HH22 2.882 2.025 |
| 7502 | | /E ARG 357 NH2 /I DT 16 O4' /E ARG 357 HH22 3.135 2.386 |
| 7503 | | /E GLU 358 N /H DG 41 OP1 /E GLU 358 H 2.888 1.905 |
| 7504 | | /E THR 359 N /E ARG 357 O /E THR 359 H 3.010 2.141 |
| 7505 | | /E THR 359 OG1 /I DG 19 OP1 /E THR 359 HG1 2.802 2.243 |
| 7506 | | /E ARG 362 N /I DG 19 O3' /E ARG 362 H 3.350 2.344 |
| 7507 | | /E ARG 362 NH1 /I DT 18 O2 /E ARG 362 HH12 2.975 2.081 |
| 7508 | | /E ARG 362 NH1 /I DG 19 O4' /E ARG 362 HH11 3.022 2.183 |
| 7509 | | /E ARG 362 NH2 /H DT 38 O2 /E ARG 362 HH22 2.881 2.130 |
| 7510 | | /E ARG 362 NH2 /H DA 39 O4' /E ARG 362 HH21 3.366 2.779 |
| 7511 | | /E LYS 363 N /I DC 20 OP2 /E LYS 363 H 3.408 2.442 |
| 7512 | | /E LYS 363 NZ /I DA 21 OP1 /E LYS 363 HZ1 2.944 1.968 |
| 7513 | | /G THR 542 N /G LYS 581 O /G THR 542 H 2.775 1.833 |
| 7514 | | /G THR 542 OG1 /G LYS 581 O /G THR 542 HG1 3.224 2.270 |
| 7515 | | /G GLY 543 N /H DA 26 OP1 /G GLY 543 H 2.943 2.343 |
| 7516 | | /G CYS 545 SG /G GLY 543 O /G CYS 545 HG 3.840 2.525 |
| 7517 | | /G GLY 546 N /H DA 27 OP1 /G GLY 546 H 2.915 2.028 |
| 7518 | | /G LYS 547 NZ /I DG 31 O3' /G LYS 547 HZ2 2.870 2.326 |
| 7519 | | /G LYS 547 NZ /I DG 32 OP1 /G LYS 547 HZ1 2.552 1.558 |
| 7520 | | /G LYS 548 NZ /H DA 27 N3 /G LYS 548 HZ1 2.902 2.236 |
| 7521 | | /G LYS 548 NZ /H DG 28 O4' /G LYS 548 HZ2 2.987 2.212 |
| 7522 | | /G LYS 548 NZ /I DT 29 O2 /G LYS 548 HZ3 3.197 2.248 |
| 7523 | | /G ASN 553 N /I DG 32 OP2 /G ASN 553 H 2.957 2.079 |
| 7524 | | /G ASN 553 ND2 /G GLY 572 O /G ASN 553 HD22 2.832 2.022 |
| 7525 | | /G ARG 557 NH1 /I DG 34 O6 /G ARG 557 HH12 2.913 1.906 |
| 7526 | | /G ARG 557 NH2 /I DG 34 N7 /G ARG 557 HH22 2.372 1.443 |
| 7527 | | /G LYS 560 NZ /H DA 15 OP1 /G LYS 560 HZ3 3.180 2.601 |
| 7528 | | /G GLY 561 N /H DT 16 OP1 /G GLY 561 H 3.390 2.598 |
| 7529 | | /G GLY 561 N /H DT 16 OP2 /G GLY 561 H 2.846 2.111 |
| 7530 | | /G THR 563 N /H DT 16 OP1 /G THR 563 H 2.931 2.306 |
| 7531 | | /G THR 563 OG1 /H DT 16 OP1 /G THR 563 HG1 3.027 2.078 |
| 7532 | | /G ALA 565 N /H DA 17 OP2 /G ALA 565 H 2.576 1.574 |
| 7533 | | /G VAL 570 N /G ASN 553 O /G VAL 570 H 3.200 2.301 |
| 7534 | | /G TYR 571 N /G ASN 553 OD1 /G TYR 571 H 3.237 2.453 |
| 7535 | | /G ARG 574 NH2 /G GLY 551 O /G ARG 574 HH22 2.887 1.879 |
| 7536 | | /G ARG 574 NH2 /I DG 32 OP1 /G ARG 574 HH21 3.076 2.128 |
| 7537 | | /G ASP 576 N /G ARG 574 O /G ASP 576 H 2.809 1.912 |
| 7538 | | /G LYS 581 N /G THR 542 O /G LYS 581 H 3.429 2.627 |
| 7539 | | /G LYS 581 N /G GLY 543 O /G LYS 581 H 3.308 2.380 |
| 7540 | | /G LYS 581 NZ /H DA 26 O5' /G LYS 581 HZ1 3.367 2.792 |
| 7541 | | /G LYS 581 NZ /H DA 26 OP2 /G LYS 581 HZ1 3.143 2.140 |
| 7542 | | |
| 7543 | | |
| 7544 | | |
| 7545 | | 139 hydrogen bonds found |
| 7546 | | 44 strict hydrogen bonds found |
| 7547 | | |
| 7548 | | > select up |
| 7549 | | |
| 7550 | | 2686 atoms, 2716 bonds, 122 residues, 1 model selected |
| 7551 | | |
| 7552 | | > show sel atoms |
| 7553 | | |
| 7554 | | > select nucleic |
| 7555 | | |
| 7556 | | 2291 atoms, 2469 bonds, 72 residues, 1 model selected |
| 7557 | | |
| 7558 | | > hbonds sel saveFile "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 7559 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 7560 | | > structures/PDBs/ylODC_54bp-oriC061_complete/hbond- |
| 7561 | | > generation2_ver31_relaxed40" restrict #2/A,B,C,D,E,F,G angleSlop 40.0 |
| 7562 | | > twoColors true slopColor #ff9300 intraRes false select true reveal true log |
| 7563 | | > true |
| 7564 | | |
| 7565 | | |
| 7566 | | Finding intermodel H-bonds |
| 7567 | | Finding intramodel H-bonds |
| 7568 | | Constraints relaxed by 0.4 angstroms and 40 degrees |
| 7569 | | Models used: |
| 7570 | | 2 ylODC_54bpOriC061_rev31_PostPhenix.pdb |
| 7571 | | |
| 7572 | | 75 H-bonds |
| 7573 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 7574 | | /A ARG 301 NE /I DC 47 OP1 /A ARG 301 HE 3.042 2.096 |
| 7575 | | /A ARG 301 NH1 /H DT 10 O2 /A ARG 301 HH12 2.780 1.937 |
| 7576 | | /A ARG 301 NH1 /H DC 11 O4' /A ARG 301 HH11 2.808 1.918 |
| 7577 | | /A ARG 301 NH2 /I DT 46 O2 /A ARG 301 HH22 3.419 2.726 |
| 7578 | | /A ARG 301 NH2 /I DC 47 OP1 /A ARG 301 HH21 3.241 2.383 |
| 7579 | | /A PHE 303 N /H DC 13 OP1 /A PHE 303 H 2.683 1.713 |
| 7580 | | /A LYS 305 NZ /H DA 14 OP1 /A LYS 305 HZ1 3.005 2.074 |
| 7581 | | /A ASN 435 ND2 /H DC 13 OP2 /A ASN 435 HD22 2.896 1.911 |
| 7582 | | /A ASN 436 ND2 /H DC 13 OP2 /A ASN 436 HD22 3.172 2.251 |
| 7583 | | /B LYS 148 NZ /I DG 19 OP1 /B LYS 148 HZ3 2.880 2.062 |
| 7584 | | /B ARG 150 NH1 /H DG 35 O6 /B ARG 150 HH12 3.317 2.492 |
| 7585 | | /B ARG 150 NH1 /I DG 19 O6 /B ARG 150 HH12 3.200 2.518 |
| 7586 | | /B ARG 150 NH2 /H DG 35 O6 /B ARG 150 HH22 2.932 1.954 |
| 7587 | | /B GLY 153 N /H DT 34 OP2 /B GLY 153 H 2.955 1.965 |
| 7588 | | /B LYS 248 NZ /I DA 37 O3' /B LYS 248 HZ1 3.058 2.307 |
| 7589 | | /B LYS 279 N /I DA 39 OP1 /B LYS 279 H 3.012 2.176 |
| 7590 | | /B ASP 280 N /I DA 39 OP1 /B ASP 280 H 3.419 2.439 |
| 7591 | | /C LYS 188 NZ /H DT 18 OP1 /C LYS 188 HZ1 2.597 1.602 |
| 7592 | | /C ARG 219 N /I DT 41 OP1 /C ARG 219 H 2.860 1.859 |
| 7593 | | /C ARG 219 NH1 /I DT 40 OP1 /C ARG 219 HH11 2.808 2.044 |
| 7594 | | /C ARG 220 NH1 /H DA 15 N3 /C ARG 220 HH12 3.522 2.929 |
| 7595 | | /C ARG 220 NH1 /H DT 16 O2 /C ARG 220 HH11 3.328 2.600 |
| 7596 | | /C ARG 220 NH1 /I DT 40 O2 /C ARG 220 HH11 3.062 2.380 |
| 7597 | | /C TYR 223 OH /H DA 17 O3' /C TYR 223 HH 2.926 2.064 |
| 7598 | | /C TYR 607 OH /H DC 32 OP2 /C TYR 607 HH 3.278 2.327 |
| 7599 | | /C LYS 671 N /H DC 32 OP1 /C LYS 671 H 2.864 2.159 |
| 7600 | | /C ARG 672 N /H DC 32 OP1 /C ARG 672 H 2.895 1.905 |
| 7601 | | /C ARG 672 NH1 /I DT 25 O2 /C ARG 672 HH12 2.707 1.845 |
| 7602 | | /C ARG 672 NH2 /I DT 25 O2 /C ARG 672 HH22 3.408 2.771 |
| 7603 | | /C LYS 673 NZ /H DA 33 OP1 /C LYS 673 HZ1 2.886 1.972 |
| 7604 | | /D LYS 168 NZ /H DA 14 N3 /D LYS 168 HZ1 2.838 1.847 |
| 7605 | | /D SER 169 OG /H DA 14 O3' /D SER 169 HG 3.382 2.801 |
| 7606 | | /D SER 169 OG /H DA 15 OP2 /D SER 169 HG 2.801 1.842 |
| 7607 | | /D ILE 170 N /H DA 15 OP2 /D ILE 170 H 3.077 2.202 |
| 7608 | | /D SER 463 OG /I DG 30 OP1 /D SER 463 HG 2.493 1.565 |
| 7609 | | /D LYS 465 NZ /I DG 31 N7 /D LYS 465 HZ1 3.444 2.853 |
| 7610 | | /D LYS 465 NZ /I DG 31 O6 /D LYS 465 HZ1 2.363 1.498 |
| 7611 | | /D LYS 465 NZ /I DG 32 O6 /D LYS 465 HZ2 2.546 1.684 |
| 7612 | | /E ARG 76 NH1 /H DA 17 OP1 /E ARG 76 HH11 3.235 2.257 |
| 7613 | | /E ARG 340 NE /I DG 19 O5' /E ARG 340 HE 3.009 2.192 |
| 7614 | | /E ARG 340 NE /I DG 19 OP2 /E ARG 340 HE 2.873 1.974 |
| 7615 | | /E ARG 340 NH2 /I DG 19 OP2 /E ARG 340 HH21 3.300 2.551 |
| 7616 | | /E TYR 341 OH /I DC 20 OP1 /E TYR 341 HH 2.940 2.219 |
| 7617 | | /E ARG 356 NH1 /I DT 18 OP2 /E ARG 356 HH11 2.602 1.912 |
| 7618 | | /E ARG 357 NH1 /I DT 16 O2 /E ARG 357 HH12 2.784 1.882 |
| 7619 | | /E ARG 357 NH2 /I DT 16 O2 /E ARG 357 HH22 2.882 2.025 |
| 7620 | | /E ARG 357 NH2 /I DT 16 O4' /E ARG 357 HH22 3.135 2.386 |
| 7621 | | /E GLU 358 N /H DG 41 OP1 /E GLU 358 H 2.888 1.905 |
| 7622 | | /E THR 359 OG1 /I DG 19 OP1 /E THR 359 HG1 2.802 2.243 |
| 7623 | | /E ARG 362 N /I DG 19 O3' /E ARG 362 H 3.350 2.344 |
| 7624 | | /E ARG 362 NH1 /I DT 18 O2 /E ARG 362 HH12 2.975 2.081 |
| 7625 | | /E ARG 362 NH1 /I DG 19 O4' /E ARG 362 HH11 3.022 2.183 |
| 7626 | | /E ARG 362 NH2 /H DT 38 O2 /E ARG 362 HH22 2.881 2.130 |
| 7627 | | /E ARG 362 NH2 /H DA 39 O4' /E ARG 362 HH21 3.366 2.779 |
| 7628 | | /E LYS 363 N /I DC 20 OP2 /E LYS 363 H 3.408 2.442 |
| 7629 | | /E LYS 363 NZ /I DA 21 OP1 /E LYS 363 HZ1 2.944 1.968 |
| 7630 | | /G GLY 543 N /H DA 26 OP1 /G GLY 543 H 2.943 2.343 |
| 7631 | | /G GLY 546 N /H DA 27 OP1 /G GLY 546 H 2.915 2.028 |
| 7632 | | /G LYS 547 NZ /I DG 31 O3' /G LYS 547 HZ2 2.870 2.326 |
| 7633 | | /G LYS 547 NZ /I DG 32 OP1 /G LYS 547 HZ1 2.552 1.558 |
| 7634 | | /G LYS 548 NZ /H DA 27 N3 /G LYS 548 HZ1 2.902 2.236 |
| 7635 | | /G LYS 548 NZ /H DG 28 O4' /G LYS 548 HZ2 2.987 2.212 |
| 7636 | | /G LYS 548 NZ /I DT 29 O2 /G LYS 548 HZ3 3.197 2.248 |
| 7637 | | /G ASN 553 N /I DG 32 OP2 /G ASN 553 H 2.957 2.079 |
| 7638 | | /G ARG 557 NH1 /I DG 34 O6 /G ARG 557 HH12 2.913 1.906 |
| 7639 | | /G ARG 557 NH2 /I DG 34 N7 /G ARG 557 HH22 2.372 1.443 |
| 7640 | | /G LYS 560 NZ /H DA 15 OP1 /G LYS 560 HZ3 3.180 2.601 |
| 7641 | | /G GLY 561 N /H DT 16 OP1 /G GLY 561 H 3.390 2.598 |
| 7642 | | /G GLY 561 N /H DT 16 OP2 /G GLY 561 H 2.846 2.111 |
| 7643 | | /G THR 563 N /H DT 16 OP1 /G THR 563 H 2.931 2.306 |
| 7644 | | /G THR 563 OG1 /H DT 16 OP1 /G THR 563 HG1 3.027 2.078 |
| 7645 | | /G ALA 565 N /H DA 17 OP2 /G ALA 565 H 2.576 1.574 |
| 7646 | | /G ARG 574 NH2 /I DG 32 OP1 /G ARG 574 HH21 3.076 2.128 |
| 7647 | | /G LYS 581 NZ /H DA 26 O5' /G LYS 581 HZ1 3.367 2.792 |
| 7648 | | /G LYS 581 NZ /H DA 26 OP2 /G LYS 581 HZ1 3.143 2.140 |
| 7649 | | |
| 7650 | | |
| 7651 | | |
| 7652 | | 75 hydrogen bonds found |
| 7653 | | 21 strict hydrogen bonds found |
| 7654 | | |
| 7655 | | > select up |
| 7656 | | |
| 7657 | | 1974 atoms, 2022 bonds, 80 residues, 1 model selected |
| 7658 | | |
| 7659 | | > show sel atoms |
| 7660 | | |
| 7661 | | > select clear |
| 7662 | | |
| 7663 | | > select nucleic |
| 7664 | | |
| 7665 | | 2291 atoms, 2469 bonds, 72 residues, 1 model selected |
| 7666 | | |
| 7667 | | > hbonds sel saveFile "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 7668 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 7669 | | > structures/PDBs/ylODC_54bp-oriC061_complete/hbond-generation2_ver31" dashes |
| 7670 | | > 6 restrict #2/A,B,C,D,E,F,G twoColors true slopColor #00f900 intraRes false |
| 7671 | | > select true reveal true retainCurrent true log true |
| 7672 | | |
| 7673 | | |
| 7674 | | Finding intermodel H-bonds |
| 7675 | | Finding intramodel H-bonds |
| 7676 | | Constraints relaxed by 0.4 angstroms and 20 degrees |
| 7677 | | Models used: |
| 7678 | | 2 ylODC_54bpOriC061_rev31_PostPhenix.pdb |
| 7679 | | |
| 7680 | | 61 H-bonds |
| 7681 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 7682 | | /A ARG 301 NE /I DC 47 OP1 /A ARG 301 HE 3.042 2.096 |
| 7683 | | /A ARG 301 NH1 /H DT 10 O2 /A ARG 301 HH12 2.780 1.937 |
| 7684 | | /A ARG 301 NH1 /H DC 11 O4' /A ARG 301 HH11 2.808 1.918 |
| 7685 | | /A ARG 301 NH2 /I DT 46 O2 /A ARG 301 HH22 3.419 2.726 |
| 7686 | | /A ARG 301 NH2 /I DC 47 OP1 /A ARG 301 HH21 3.241 2.383 |
| 7687 | | /A PHE 303 N /H DC 13 OP1 /A PHE 303 H 2.683 1.713 |
| 7688 | | /A LYS 305 NZ /H DA 14 OP1 /A LYS 305 HZ1 3.005 2.074 |
| 7689 | | /A ASN 435 ND2 /H DC 13 OP2 /A ASN 435 HD22 2.896 1.911 |
| 7690 | | /A ASN 436 ND2 /H DC 13 OP2 /A ASN 436 HD22 3.172 2.251 |
| 7691 | | /B LYS 148 NZ /I DG 19 OP1 /B LYS 148 HZ3 2.880 2.062 |
| 7692 | | /B ARG 150 NH1 /H DG 35 O6 /B ARG 150 HH12 3.317 2.492 |
| 7693 | | /B ARG 150 NH1 /I DG 19 O6 /B ARG 150 HH12 3.200 2.518 |
| 7694 | | /B ARG 150 NH2 /H DG 35 O6 /B ARG 150 HH22 2.932 1.954 |
| 7695 | | /B GLY 153 N /H DT 34 OP2 /B GLY 153 H 2.955 1.965 |
| 7696 | | /B LYS 248 NZ /I DA 37 O3' /B LYS 248 HZ1 3.058 2.307 |
| 7697 | | /B LYS 279 N /I DA 39 OP1 /B LYS 279 H 3.012 2.176 |
| 7698 | | /B ASP 280 N /I DA 39 OP1 /B ASP 280 H 3.419 2.439 |
| 7699 | | /C LYS 188 NZ /H DT 18 OP1 /C LYS 188 HZ1 2.597 1.602 |
| 7700 | | /C ARG 219 N /I DT 41 OP1 /C ARG 219 H 2.860 1.859 |
| 7701 | | /C ARG 219 NH1 /I DT 40 OP1 /C ARG 219 HH11 2.808 2.044 |
| 7702 | | /C ARG 220 NH1 /H DT 16 O2 /C ARG 220 HH11 3.328 2.600 |
| 7703 | | /C ARG 220 NH1 /I DT 40 O2 /C ARG 220 HH11 3.062 2.380 |
| 7704 | | /C TYR 223 OH /H DA 17 O3' /C TYR 223 HH 2.926 2.064 |
| 7705 | | /C TYR 607 OH /H DC 32 OP2 /C TYR 607 HH 3.278 2.327 |
| 7706 | | /C ARG 672 N /H DC 32 OP1 /C ARG 672 H 2.895 1.905 |
| 7707 | | /C ARG 672 NH1 /I DT 25 O2 /C ARG 672 HH12 2.707 1.845 |
| 7708 | | /C ARG 672 NH2 /I DT 25 O2 /C ARG 672 HH22 3.408 2.771 |
| 7709 | | /C LYS 673 NZ /H DA 33 OP1 /C LYS 673 HZ1 2.886 1.972 |
| 7710 | | /D LYS 168 NZ /H DA 14 N3 /D LYS 168 HZ1 2.838 1.847 |
| 7711 | | /D SER 169 OG /H DA 15 OP2 /D SER 169 HG 2.801 1.842 |
| 7712 | | /D ILE 170 N /H DA 15 OP2 /D ILE 170 H 3.077 2.202 |
| 7713 | | /D SER 463 OG /I DG 30 OP1 /D SER 463 HG 2.493 1.565 |
| 7714 | | /D LYS 465 NZ /I DG 31 O6 /D LYS 465 HZ1 2.363 1.498 |
| 7715 | | /D LYS 465 NZ /I DG 32 O6 /D LYS 465 HZ2 2.546 1.684 |
| 7716 | | /E ARG 76 NH1 /H DA 17 OP1 /E ARG 76 HH11 3.235 2.257 |
| 7717 | | /E ARG 340 NE /I DG 19 O5' /E ARG 340 HE 3.009 2.192 |
| 7718 | | /E ARG 340 NE /I DG 19 OP2 /E ARG 340 HE 2.873 1.974 |
| 7719 | | /E ARG 340 NH2 /I DG 19 OP2 /E ARG 340 HH21 3.300 2.551 |
| 7720 | | /E TYR 341 OH /I DC 20 OP1 /E TYR 341 HH 2.940 2.219 |
| 7721 | | /E ARG 357 NH1 /I DT 16 O2 /E ARG 357 HH12 2.784 1.882 |
| 7722 | | /E ARG 357 NH2 /I DT 16 O2 /E ARG 357 HH22 2.882 2.025 |
| 7723 | | /E ARG 357 NH2 /I DT 16 O4' /E ARG 357 HH22 3.135 2.386 |
| 7724 | | /E GLU 358 N /H DG 41 OP1 /E GLU 358 H 2.888 1.905 |
| 7725 | | /E THR 359 OG1 /I DG 19 OP1 /E THR 359 HG1 2.802 2.243 |
| 7726 | | /E ARG 362 N /I DG 19 O3' /E ARG 362 H 3.350 2.344 |
| 7727 | | /E ARG 362 NH1 /I DT 18 O2 /E ARG 362 HH12 2.975 2.081 |
| 7728 | | /E ARG 362 NH1 /I DG 19 O4' /E ARG 362 HH11 3.022 2.183 |
| 7729 | | /E ARG 362 NH2 /H DT 38 O2 /E ARG 362 HH22 2.881 2.130 |
| 7730 | | /E LYS 363 N /I DC 20 OP2 /E LYS 363 H 3.408 2.442 |
| 7731 | | /E LYS 363 NZ /I DA 21 OP1 /E LYS 363 HZ1 2.944 1.968 |
| 7732 | | /G GLY 546 N /H DA 27 OP1 /G GLY 546 H 2.915 2.028 |
| 7733 | | /G LYS 547 NZ /I DG 32 OP1 /G LYS 547 HZ1 2.552 1.558 |
| 7734 | | /G LYS 548 NZ /I DT 29 O2 /G LYS 548 HZ3 3.197 2.248 |
| 7735 | | /G ASN 553 N /I DG 32 OP2 /G ASN 553 H 2.957 2.079 |
| 7736 | | /G ARG 557 NH1 /I DG 34 O6 /G ARG 557 HH12 2.913 1.906 |
| 7737 | | /G ARG 557 NH2 /I DG 34 N7 /G ARG 557 HH22 2.372 1.443 |
| 7738 | | /G GLY 561 N /H DT 16 OP2 /G GLY 561 H 2.846 2.111 |
| 7739 | | /G THR 563 OG1 /H DT 16 OP1 /G THR 563 HG1 3.027 2.078 |
| 7740 | | /G ALA 565 N /H DA 17 OP2 /G ALA 565 H 2.576 1.574 |
| 7741 | | /G ARG 574 NH2 /I DG 32 OP1 /G ARG 574 HH21 3.076 2.128 |
| 7742 | | /G LYS 581 NZ /H DA 26 OP2 /G LYS 581 HZ1 3.143 2.140 |
| 7743 | | |
| 7744 | | |
| 7745 | | |
| 7746 | | 61 hydrogen bonds found |
| 7747 | | 21 strict hydrogen bonds found |
| 7748 | | |
| 7749 | | > select clear |
| 7750 | | |
| 7751 | | > select ~sel & ##selected |
| 7752 | | |
| 7753 | | Nothing selected |
| 7754 | | |
| 7755 | | > select ~nucleic |
| 7756 | | |
| 7757 | | 47733 atoms, 48183 bonds, 11 pseudobonds, 2978 residues, 3 models selected |
| 7758 | | |
| 7759 | | > hide sel cartoons |
| 7760 | | |
| 7761 | | > select clear |
| 7762 | | |
| 7763 | | > save "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 7764 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 7765 | | > structures/PDBs/ylODC_54bp-oriC061_complete/new_hbond_ver31.cxs" |
| 7766 | | |
| 7767 | | > select /I:18 |
| 7768 | | |
| 7769 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 7770 | | |
| 7771 | | > hide sel cartoons |
| 7772 | | |
| 7773 | | > show sel cartoons |
| 7774 | | |
| 7775 | | > select /I:16 |
| 7776 | | |
| 7777 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 7778 | | |
| 7779 | | > hide sel atoms |
| 7780 | | |
| 7781 | | > select clear |
| 7782 | | |
| 7783 | | > hide atoms |
| 7784 | | |
| 7785 | | > select nucleic |
| 7786 | | |
| 7787 | | 2291 atoms, 2469 bonds, 72 residues, 1 model selected |
| 7788 | | |
| 7789 | | > hbonds sel dashes 6 restrict #2/A,B,C,D,E,F,G angleSlop 40.0 twoColors true |
| 7790 | | > slopColor #ff9300 intraRes false select true reveal true retainCurrent true |
| 7791 | | > log true |
| 7792 | | |
| 7793 | | |
| 7794 | | Finding intermodel H-bonds |
| 7795 | | Finding intramodel H-bonds |
| 7796 | | Constraints relaxed by 0.4 angstroms and 40 degrees |
| 7797 | | Models used: |
| 7798 | | 2 ylODC_54bpOriC061_rev31_PostPhenix.pdb |
| 7799 | | |
| 7800 | | 75 H-bonds |
| 7801 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 7802 | | /A ARG 301 NE /I DC 47 OP1 /A ARG 301 HE 3.042 2.096 |
| 7803 | | /A ARG 301 NH1 /H DT 10 O2 /A ARG 301 HH12 2.780 1.937 |
| 7804 | | /A ARG 301 NH1 /H DC 11 O4' /A ARG 301 HH11 2.808 1.918 |
| 7805 | | /A ARG 301 NH2 /I DT 46 O2 /A ARG 301 HH22 3.419 2.726 |
| 7806 | | /A ARG 301 NH2 /I DC 47 OP1 /A ARG 301 HH21 3.241 2.383 |
| 7807 | | /A PHE 303 N /H DC 13 OP1 /A PHE 303 H 2.683 1.713 |
| 7808 | | /A LYS 305 NZ /H DA 14 OP1 /A LYS 305 HZ1 3.005 2.074 |
| 7809 | | /A ASN 435 ND2 /H DC 13 OP2 /A ASN 435 HD22 2.896 1.911 |
| 7810 | | /A ASN 436 ND2 /H DC 13 OP2 /A ASN 436 HD22 3.172 2.251 |
| 7811 | | /B LYS 148 NZ /I DG 19 OP1 /B LYS 148 HZ3 2.880 2.062 |
| 7812 | | /B ARG 150 NH1 /H DG 35 O6 /B ARG 150 HH12 3.317 2.492 |
| 7813 | | /B ARG 150 NH1 /I DG 19 O6 /B ARG 150 HH12 3.200 2.518 |
| 7814 | | /B ARG 150 NH2 /H DG 35 O6 /B ARG 150 HH22 2.932 1.954 |
| 7815 | | /B GLY 153 N /H DT 34 OP2 /B GLY 153 H 2.955 1.965 |
| 7816 | | /B LYS 248 NZ /I DA 37 O3' /B LYS 248 HZ1 3.058 2.307 |
| 7817 | | /B LYS 279 N /I DA 39 OP1 /B LYS 279 H 3.012 2.176 |
| 7818 | | /B ASP 280 N /I DA 39 OP1 /B ASP 280 H 3.419 2.439 |
| 7819 | | /C LYS 188 NZ /H DT 18 OP1 /C LYS 188 HZ1 2.597 1.602 |
| 7820 | | /C ARG 219 N /I DT 41 OP1 /C ARG 219 H 2.860 1.859 |
| 7821 | | /C ARG 219 NH1 /I DT 40 OP1 /C ARG 219 HH11 2.808 2.044 |
| 7822 | | /C ARG 220 NH1 /H DA 15 N3 /C ARG 220 HH12 3.522 2.929 |
| 7823 | | /C ARG 220 NH1 /H DT 16 O2 /C ARG 220 HH11 3.328 2.600 |
| 7824 | | /C ARG 220 NH1 /I DT 40 O2 /C ARG 220 HH11 3.062 2.380 |
| 7825 | | /C TYR 223 OH /H DA 17 O3' /C TYR 223 HH 2.926 2.064 |
| 7826 | | /C TYR 607 OH /H DC 32 OP2 /C TYR 607 HH 3.278 2.327 |
| 7827 | | /C LYS 671 N /H DC 32 OP1 /C LYS 671 H 2.864 2.159 |
| 7828 | | /C ARG 672 N /H DC 32 OP1 /C ARG 672 H 2.895 1.905 |
| 7829 | | /C ARG 672 NH1 /I DT 25 O2 /C ARG 672 HH12 2.707 1.845 |
| 7830 | | /C ARG 672 NH2 /I DT 25 O2 /C ARG 672 HH22 3.408 2.771 |
| 7831 | | /C LYS 673 NZ /H DA 33 OP1 /C LYS 673 HZ1 2.886 1.972 |
| 7832 | | /D LYS 168 NZ /H DA 14 N3 /D LYS 168 HZ1 2.838 1.847 |
| 7833 | | /D SER 169 OG /H DA 14 O3' /D SER 169 HG 3.382 2.801 |
| 7834 | | /D SER 169 OG /H DA 15 OP2 /D SER 169 HG 2.801 1.842 |
| 7835 | | /D ILE 170 N /H DA 15 OP2 /D ILE 170 H 3.077 2.202 |
| 7836 | | /D SER 463 OG /I DG 30 OP1 /D SER 463 HG 2.493 1.565 |
| 7837 | | /D LYS 465 NZ /I DG 31 N7 /D LYS 465 HZ1 3.444 2.853 |
| 7838 | | /D LYS 465 NZ /I DG 31 O6 /D LYS 465 HZ1 2.363 1.498 |
| 7839 | | /D LYS 465 NZ /I DG 32 O6 /D LYS 465 HZ2 2.546 1.684 |
| 7840 | | /E ARG 76 NH1 /H DA 17 OP1 /E ARG 76 HH11 3.235 2.257 |
| 7841 | | /E ARG 340 NE /I DG 19 O5' /E ARG 340 HE 3.009 2.192 |
| 7842 | | /E ARG 340 NE /I DG 19 OP2 /E ARG 340 HE 2.873 1.974 |
| 7843 | | /E ARG 340 NH2 /I DG 19 OP2 /E ARG 340 HH21 3.300 2.551 |
| 7844 | | /E TYR 341 OH /I DC 20 OP1 /E TYR 341 HH 2.940 2.219 |
| 7845 | | /E ARG 356 NH1 /I DT 18 OP2 /E ARG 356 HH11 2.602 1.912 |
| 7846 | | /E ARG 357 NH1 /I DT 16 O2 /E ARG 357 HH12 2.784 1.882 |
| 7847 | | /E ARG 357 NH2 /I DT 16 O2 /E ARG 357 HH22 2.882 2.025 |
| 7848 | | /E ARG 357 NH2 /I DT 16 O4' /E ARG 357 HH22 3.135 2.386 |
| 7849 | | /E GLU 358 N /H DG 41 OP1 /E GLU 358 H 2.888 1.905 |
| 7850 | | /E THR 359 OG1 /I DG 19 OP1 /E THR 359 HG1 2.802 2.243 |
| 7851 | | /E ARG 362 N /I DG 19 O3' /E ARG 362 H 3.350 2.344 |
| 7852 | | /E ARG 362 NH1 /I DT 18 O2 /E ARG 362 HH12 2.975 2.081 |
| 7853 | | /E ARG 362 NH1 /I DG 19 O4' /E ARG 362 HH11 3.022 2.183 |
| 7854 | | /E ARG 362 NH2 /H DT 38 O2 /E ARG 362 HH22 2.881 2.130 |
| 7855 | | /E ARG 362 NH2 /H DA 39 O4' /E ARG 362 HH21 3.366 2.779 |
| 7856 | | /E LYS 363 N /I DC 20 OP2 /E LYS 363 H 3.408 2.442 |
| 7857 | | /E LYS 363 NZ /I DA 21 OP1 /E LYS 363 HZ1 2.944 1.968 |
| 7858 | | /G GLY 543 N /H DA 26 OP1 /G GLY 543 H 2.943 2.343 |
| 7859 | | /G GLY 546 N /H DA 27 OP1 /G GLY 546 H 2.915 2.028 |
| 7860 | | /G LYS 547 NZ /I DG 31 O3' /G LYS 547 HZ2 2.870 2.326 |
| 7861 | | /G LYS 547 NZ /I DG 32 OP1 /G LYS 547 HZ1 2.552 1.558 |
| 7862 | | /G LYS 548 NZ /H DA 27 N3 /G LYS 548 HZ1 2.902 2.236 |
| 7863 | | /G LYS 548 NZ /H DG 28 O4' /G LYS 548 HZ2 2.987 2.212 |
| 7864 | | /G LYS 548 NZ /I DT 29 O2 /G LYS 548 HZ3 3.197 2.248 |
| 7865 | | /G ASN 553 N /I DG 32 OP2 /G ASN 553 H 2.957 2.079 |
| 7866 | | /G ARG 557 NH1 /I DG 34 O6 /G ARG 557 HH12 2.913 1.906 |
| 7867 | | /G ARG 557 NH2 /I DG 34 N7 /G ARG 557 HH22 2.372 1.443 |
| 7868 | | /G LYS 560 NZ /H DA 15 OP1 /G LYS 560 HZ3 3.180 2.601 |
| 7869 | | /G GLY 561 N /H DT 16 OP1 /G GLY 561 H 3.390 2.598 |
| 7870 | | /G GLY 561 N /H DT 16 OP2 /G GLY 561 H 2.846 2.111 |
| 7871 | | /G THR 563 N /H DT 16 OP1 /G THR 563 H 2.931 2.306 |
| 7872 | | /G THR 563 OG1 /H DT 16 OP1 /G THR 563 HG1 3.027 2.078 |
| 7873 | | /G ALA 565 N /H DA 17 OP2 /G ALA 565 H 2.576 1.574 |
| 7874 | | /G ARG 574 NH2 /I DG 32 OP1 /G ARG 574 HH21 3.076 2.128 |
| 7875 | | /G LYS 581 NZ /H DA 26 O5' /G LYS 581 HZ1 3.367 2.792 |
| 7876 | | /G LYS 581 NZ /H DA 26 OP2 /G LYS 581 HZ1 3.143 2.140 |
| 7877 | | |
| 7878 | | |
| 7879 | | |
| 7880 | | 75 hydrogen bonds found |
| 7881 | | 21 strict hydrogen bonds found |
| 7882 | | |
| 7883 | | > select up |
| 7884 | | |
| 7885 | | 1974 atoms, 2022 bonds, 80 residues, 1 model selected |
| 7886 | | |
| 7887 | | > show sel atoms |
| 7888 | | |
| 7889 | | > select nucleic |
| 7890 | | |
| 7891 | | 2291 atoms, 2469 bonds, 72 residues, 1 model selected |
| 7892 | | |
| 7893 | | > show sel atoms |
| 7894 | | |
| 7895 | | > hbonds sel dashes 6 restrict #2/A,B,C,D,E,F,G twoColors true slopColor |
| 7896 | | > #00f900 intraRes false select true reveal true retainCurrent true log true |
| 7897 | | |
| 7898 | | |
| 7899 | | Finding intermodel H-bonds |
| 7900 | | Finding intramodel H-bonds |
| 7901 | | Constraints relaxed by 0.4 angstroms and 20 degrees |
| 7902 | | Models used: |
| 7903 | | 2 ylODC_54bpOriC061_rev31_PostPhenix.pdb |
| 7904 | | |
| 7905 | | 61 H-bonds |
| 7906 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 7907 | | /A ARG 301 NE /I DC 47 OP1 /A ARG 301 HE 3.042 2.096 |
| 7908 | | /A ARG 301 NH1 /H DT 10 O2 /A ARG 301 HH12 2.780 1.937 |
| 7909 | | /A ARG 301 NH1 /H DC 11 O4' /A ARG 301 HH11 2.808 1.918 |
| 7910 | | /A ARG 301 NH2 /I DT 46 O2 /A ARG 301 HH22 3.419 2.726 |
| 7911 | | /A ARG 301 NH2 /I DC 47 OP1 /A ARG 301 HH21 3.241 2.383 |
| 7912 | | /A PHE 303 N /H DC 13 OP1 /A PHE 303 H 2.683 1.713 |
| 7913 | | /A LYS 305 NZ /H DA 14 OP1 /A LYS 305 HZ1 3.005 2.074 |
| 7914 | | /A ASN 435 ND2 /H DC 13 OP2 /A ASN 435 HD22 2.896 1.911 |
| 7915 | | /A ASN 436 ND2 /H DC 13 OP2 /A ASN 436 HD22 3.172 2.251 |
| 7916 | | /B LYS 148 NZ /I DG 19 OP1 /B LYS 148 HZ3 2.880 2.062 |
| 7917 | | /B ARG 150 NH1 /H DG 35 O6 /B ARG 150 HH12 3.317 2.492 |
| 7918 | | /B ARG 150 NH1 /I DG 19 O6 /B ARG 150 HH12 3.200 2.518 |
| 7919 | | /B ARG 150 NH2 /H DG 35 O6 /B ARG 150 HH22 2.932 1.954 |
| 7920 | | /B GLY 153 N /H DT 34 OP2 /B GLY 153 H 2.955 1.965 |
| 7921 | | /B LYS 248 NZ /I DA 37 O3' /B LYS 248 HZ1 3.058 2.307 |
| 7922 | | /B LYS 279 N /I DA 39 OP1 /B LYS 279 H 3.012 2.176 |
| 7923 | | /B ASP 280 N /I DA 39 OP1 /B ASP 280 H 3.419 2.439 |
| 7924 | | /C LYS 188 NZ /H DT 18 OP1 /C LYS 188 HZ1 2.597 1.602 |
| 7925 | | /C ARG 219 N /I DT 41 OP1 /C ARG 219 H 2.860 1.859 |
| 7926 | | /C ARG 219 NH1 /I DT 40 OP1 /C ARG 219 HH11 2.808 2.044 |
| 7927 | | /C ARG 220 NH1 /H DT 16 O2 /C ARG 220 HH11 3.328 2.600 |
| 7928 | | /C ARG 220 NH1 /I DT 40 O2 /C ARG 220 HH11 3.062 2.380 |
| 7929 | | /C TYR 223 OH /H DA 17 O3' /C TYR 223 HH 2.926 2.064 |
| 7930 | | /C TYR 607 OH /H DC 32 OP2 /C TYR 607 HH 3.278 2.327 |
| 7931 | | /C ARG 672 N /H DC 32 OP1 /C ARG 672 H 2.895 1.905 |
| 7932 | | /C ARG 672 NH1 /I DT 25 O2 /C ARG 672 HH12 2.707 1.845 |
| 7933 | | /C ARG 672 NH2 /I DT 25 O2 /C ARG 672 HH22 3.408 2.771 |
| 7934 | | /C LYS 673 NZ /H DA 33 OP1 /C LYS 673 HZ1 2.886 1.972 |
| 7935 | | /D LYS 168 NZ /H DA 14 N3 /D LYS 168 HZ1 2.838 1.847 |
| 7936 | | /D SER 169 OG /H DA 15 OP2 /D SER 169 HG 2.801 1.842 |
| 7937 | | /D ILE 170 N /H DA 15 OP2 /D ILE 170 H 3.077 2.202 |
| 7938 | | /D SER 463 OG /I DG 30 OP1 /D SER 463 HG 2.493 1.565 |
| 7939 | | /D LYS 465 NZ /I DG 31 O6 /D LYS 465 HZ1 2.363 1.498 |
| 7940 | | /D LYS 465 NZ /I DG 32 O6 /D LYS 465 HZ2 2.546 1.684 |
| 7941 | | /E ARG 76 NH1 /H DA 17 OP1 /E ARG 76 HH11 3.235 2.257 |
| 7942 | | /E ARG 340 NE /I DG 19 O5' /E ARG 340 HE 3.009 2.192 |
| 7943 | | /E ARG 340 NE /I DG 19 OP2 /E ARG 340 HE 2.873 1.974 |
| 7944 | | /E ARG 340 NH2 /I DG 19 OP2 /E ARG 340 HH21 3.300 2.551 |
| 7945 | | /E TYR 341 OH /I DC 20 OP1 /E TYR 341 HH 2.940 2.219 |
| 7946 | | /E ARG 357 NH1 /I DT 16 O2 /E ARG 357 HH12 2.784 1.882 |
| 7947 | | /E ARG 357 NH2 /I DT 16 O2 /E ARG 357 HH22 2.882 2.025 |
| 7948 | | /E ARG 357 NH2 /I DT 16 O4' /E ARG 357 HH22 3.135 2.386 |
| 7949 | | /E GLU 358 N /H DG 41 OP1 /E GLU 358 H 2.888 1.905 |
| 7950 | | /E THR 359 OG1 /I DG 19 OP1 /E THR 359 HG1 2.802 2.243 |
| 7951 | | /E ARG 362 N /I DG 19 O3' /E ARG 362 H 3.350 2.344 |
| 7952 | | /E ARG 362 NH1 /I DT 18 O2 /E ARG 362 HH12 2.975 2.081 |
| 7953 | | /E ARG 362 NH1 /I DG 19 O4' /E ARG 362 HH11 3.022 2.183 |
| 7954 | | /E ARG 362 NH2 /H DT 38 O2 /E ARG 362 HH22 2.881 2.130 |
| 7955 | | /E LYS 363 N /I DC 20 OP2 /E LYS 363 H 3.408 2.442 |
| 7956 | | /E LYS 363 NZ /I DA 21 OP1 /E LYS 363 HZ1 2.944 1.968 |
| 7957 | | /G GLY 546 N /H DA 27 OP1 /G GLY 546 H 2.915 2.028 |
| 7958 | | /G LYS 547 NZ /I DG 32 OP1 /G LYS 547 HZ1 2.552 1.558 |
| 7959 | | /G LYS 548 NZ /I DT 29 O2 /G LYS 548 HZ3 3.197 2.248 |
| 7960 | | /G ASN 553 N /I DG 32 OP2 /G ASN 553 H 2.957 2.079 |
| 7961 | | /G ARG 557 NH1 /I DG 34 O6 /G ARG 557 HH12 2.913 1.906 |
| 7962 | | /G ARG 557 NH2 /I DG 34 N7 /G ARG 557 HH22 2.372 1.443 |
| 7963 | | /G GLY 561 N /H DT 16 OP2 /G GLY 561 H 2.846 2.111 |
| 7964 | | /G THR 563 OG1 /H DT 16 OP1 /G THR 563 HG1 3.027 2.078 |
| 7965 | | /G ALA 565 N /H DA 17 OP2 /G ALA 565 H 2.576 1.574 |
| 7966 | | /G ARG 574 NH2 /I DG 32 OP1 /G ARG 574 HH21 3.076 2.128 |
| 7967 | | /G LYS 581 NZ /H DA 26 OP2 /G LYS 581 HZ1 3.143 2.140 |
| 7968 | | |
| 7969 | | |
| 7970 | | |
| 7971 | | 61 hydrogen bonds found |
| 7972 | | 21 strict hydrogen bonds found |
| 7973 | | |
| 7974 | | > select clear |
| 7975 | | |
| 7976 | | > save "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 7977 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 7978 | | > structures/PDBs/ylODC_54bp-oriC061_complete/new_hbond_ver31.cxs" |
| 7979 | | |
| 7980 | | > select /I:17 |
| 7981 | | |
| 7982 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 7983 | | |
| 7984 | | > select clear |
| 7985 | | |
| 7986 | | > select /H:26 |
| 7987 | | |
| 7988 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 7989 | | |
| 7990 | | > ui tool show "Renumber Residues" |
| 7991 | | |
| 7992 | | > renumber /H start -16 |
| 7993 | | |
| 7994 | | 37 residues renumbered |
| 7995 | | |
| 7996 | | > renumber /H start -18 |
| 7997 | | |
| 7998 | | 37 residues renumbered |
| 7999 | | |
| 8000 | | > renumber /I start -16 |
| 8001 | | |
| 8002 | | 35 residues renumbered |
| 8003 | | |
| 8004 | | > select /I |
| 8005 | | |
| 8006 | | 1121 atoms, 1207 bonds, 35 residues, 1 model selected |
| 8007 | | |
| 8008 | | > ui tool show "Change Chain IDs" |
| 8009 | | |
| 8010 | | > changechains sel opp |
| 8011 | | |
| 8012 | | Chain IDs of 35 residues changed |
| 8013 | | |
| 8014 | | > select /H |
| 8015 | | |
| 8016 | | 1170 atoms, 1262 bonds, 37 residues, 1 model selected |
| 8017 | | |
| 8018 | | > ui tool show "Change Chain IDs" |
| 8019 | | |
| 8020 | | > changechains sel main |
| 8021 | | |
| 8022 | | Chain IDs of 37 residues changed |
| 8023 | | |
| 8024 | | > select clear |
| 8025 | | |
| 8026 | | > save "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 8027 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 8028 | | > structures/PDBs/ylODC_54bp-oriC061_complete/new_hbond_ver31.cxs" |
| 8029 | | |
| 8030 | | > select /opp:-13 |
| 8031 | | |
| 8032 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 8033 | | |
| 8034 | | > select clear |
| 8035 | | |
| 8036 | | > close #2 |
| 8037 | | |
| 8038 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 8039 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 8040 | | > structures/PDBs/ylODC_oriA006_complete/ARMori_ODC_ver20_DNAchainfix_PostPhenix.pdb" |
| 8041 | | |
| 8042 | | Chain information for ARMori_ODC_ver20_DNAchainfix_PostPhenix.pdb #1 |
| 8043 | | --- |
| 8044 | | Chain | Description |
| 8045 | | A | No description available |
| 8046 | | B | No description available |
| 8047 | | C | No description available |
| 8048 | | D | No description available |
| 8049 | | E | No description available |
| 8050 | | F | No description available |
| 8051 | | G | No description available |
| 8052 | | H | No description available |
| 8053 | | I | No description available |
| 8054 | | |
| 8055 | | |
| 8056 | | > modelfix |
| 8057 | | |
| 8058 | | Changed 24882 atom styles |
| 8059 | | 23363 atoms, 23801 bonds, 15 pseudobonds, 2924 residues, 2 models selected |
| 8060 | | |
| 8061 | | > select ~nucleic |
| 8062 | | |
| 8063 | | 23491 atoms, 23933 bonds, 16 pseudobonds, 2932 residues, 3 models selected |
| 8064 | | |
| 8065 | | > hide sel cartoons |
| 8066 | | |
| 8067 | | > select nucleic |
| 8068 | | |
| 8069 | | 1391 atoms, 1559 bonds, 68 residues, 1 model selected |
| 8070 | | |
| 8071 | | > hbonds sel saveFile "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 8072 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 8073 | | > structures/PDBs/ylODC_oriA006_complete/hbond_oriA_generation_ver20_relaxed40" |
| 8074 | | > dashes 6 restrict #1/A,B,C,D,E,F,G angleSlop 40.0 twoColors true slopColor |
| 8075 | | > #ff9300 intraRes false select true reveal true retainCurrent true log true |
| 8076 | | |
| 8077 | | |
| 8078 | | Finding intermodel H-bonds |
| 8079 | | Finding intramodel H-bonds |
| 8080 | | Constraints relaxed by 0.4 angstroms and 40 degrees |
| 8081 | | Models used: |
| 8082 | | 1 ARMori_ODC_ver20_DNAchainfix_PostPhenix.pdb |
| 8083 | | |
| 8084 | | 50 H-bonds |
| 8085 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 8086 | | /A GLN 306 NE2 /I DG 53 O3' no hydrogen 3.342 N/A |
| 8087 | | /A ASN 436 ND2 /H DA 10 OP1 no hydrogen 2.810 N/A |
| 8088 | | /B LYS 148 NZ /I DA 28 OP1 no hydrogen 3.208 N/A |
| 8089 | | /B LYS 279 N /I DA 48 OP1 no hydrogen 3.110 N/A |
| 8090 | | /C LYS 188 NZ /H DC 15 OP1 no hydrogen 3.176 N/A |
| 8091 | | /C ARG 219 NH1 /I DT 49 OP2 no hydrogen 3.015 N/A |
| 8092 | | /C ARG 220 NH1 /H DT 13 O2 no hydrogen 3.388 N/A |
| 8093 | | /C ARG 220 NH1 /I DT 49 O2 no hydrogen 3.296 N/A |
| 8094 | | /C TYR 223 OH /H DC 15 OP1 no hydrogen 2.762 N/A |
| 8095 | | /C TYR 607 OH /H DC 29 OP2 no hydrogen 3.098 N/A |
| 8096 | | /C ARG 672 N /H DC 29 OP1 no hydrogen 3.388 N/A |
| 8097 | | /C ARG 672 NH1 /I DT 34 O2 no hydrogen 2.806 N/A |
| 8098 | | /C ARG 672 NH2 /I DT 34 O2 no hydrogen 2.902 N/A |
| 8099 | | /C ARG 672 NH2 /I DT 34 O4' no hydrogen 3.185 N/A |
| 8100 | | /C LYS 673 NZ /H DT 30 OP1 no hydrogen 3.030 N/A |
| 8101 | | /D LYS 168 NZ /H DT 11 O2 no hydrogen 2.564 N/A |
| 8102 | | /D SER 169 OG /H DA 12 OP1 no hydrogen 3.284 N/A |
| 8103 | | /D SER 463 OG /I DT 39 OP2 no hydrogen 2.803 N/A |
| 8104 | | /D LYS 465 NZ /I DG 40 N7 no hydrogen 3.514 N/A |
| 8105 | | /D LYS 465 NZ /I DG 40 O6 no hydrogen 3.045 N/A |
| 8106 | | /D LYS 465 NZ /I DG 41 O6 no hydrogen 3.189 N/A |
| 8107 | | /E ARG 76 NH1 /H DG 14 OP1 no hydrogen 2.908 N/A |
| 8108 | | /E ARG 340 NH1 /I DA 28 OP2 no hydrogen 3.135 N/A |
| 8109 | | /E ARG 356 NH1 /I DT 27 OP2 no hydrogen 2.946 N/A |
| 8110 | | /E ARG 357 N /I DT 27 OP1 no hydrogen 3.073 N/A |
| 8111 | | /E ARG 357 NH1 /I DT 25 O2 no hydrogen 2.761 N/A |
| 8112 | | /E ARG 357 NH2 /I DT 25 O2 no hydrogen 2.690 N/A |
| 8113 | | /E GLU 358 N /H DG 38 OP1 no hydrogen 3.275 N/A |
| 8114 | | /E THR 359 OG1 /I DA 28 OP1 no hydrogen 2.552 N/A |
| 8115 | | /E ARG 362 N /I DG 29 OP2 no hydrogen 2.892 N/A |
| 8116 | | /E ARG 362 NH1 /H DC 35 O4' no hydrogen 3.369 N/A |
| 8117 | | /E ARG 362 NH2 /H DC 35 O2 no hydrogen 3.076 N/A |
| 8118 | | /E ARG 362 NH2 /H DA 36 O4' no hydrogen 3.065 N/A |
| 8119 | | /E LYS 363 N /I DG 29 OP2 no hydrogen 3.221 N/A |
| 8120 | | /E LYS 363 NZ /I DG 30 OP1 no hydrogen 2.954 N/A |
| 8121 | | /E LYS 363 NZ /I DG 30 OP2 no hydrogen 2.890 N/A |
| 8122 | | /G THR 542 OG1 /H DA 23 OP1 no hydrogen 3.290 N/A |
| 8123 | | /G LYS 547 NZ /I DG 41 OP1 no hydrogen 3.303 N/A |
| 8124 | | /G LYS 548 NZ /H DT 24 O2 no hydrogen 2.747 N/A |
| 8125 | | /G LYS 548 NZ /H DC 25 O4' no hydrogen 2.889 N/A |
| 8126 | | /G LYS 548 NZ /I DT 38 O2 no hydrogen 3.045 N/A |
| 8127 | | /G ASN 553 N /I DG 41 OP2 no hydrogen 3.220 N/A |
| 8128 | | /G ARG 557 NH1 /I DG 44 N7 no hydrogen 3.403 N/A |
| 8129 | | /G ARG 557 NH1 /I DG 44 O6 no hydrogen 2.566 N/A |
| 8130 | | /G ARG 557 NH2 /I DG 44 N7 no hydrogen 3.082 N/A |
| 8131 | | /G LYS 560 NZ /H DA 12 OP2 no hydrogen 2.981 N/A |
| 8132 | | /G GLY 561 N /H DT 13 OP1 no hydrogen 2.977 N/A |
| 8133 | | /G THR 563 N /H DT 13 OP2 no hydrogen 3.051 N/A |
| 8134 | | /G GLY 564 N /H DT 13 OP2 no hydrogen 2.948 N/A |
| 8135 | | /G ALA 565 N /H DG 14 OP2 no hydrogen 3.032 N/A |
| 8136 | | |
| 8137 | | |
| 8138 | | |
| 8139 | | 50 hydrogen bonds found |
| 8140 | | 13 strict hydrogen bonds found |
| 8141 | | |
| 8142 | | > ui tool show "Add Hydrogens" |
| 8143 | | |
| 8144 | | > addh #!1 |
| 8145 | | |
| 8146 | | Summary of feedback from adding hydrogens to |
| 8147 | | ARMori_ODC_ver20_DNAchainfix_PostPhenix.pdb #1 |
| 8148 | | --- |
| 8149 | | warning | Not adding hydrogens to /I DA 22 P because it is missing heavy-atom bond partners |
| 8150 | | notes | No usable SEQRES records for ARMori_ODC_ver20_DNAchainfix_PostPhenix.pdb (#1) chain A; guessing termini instead |
| 8151 | | No usable SEQRES records for ARMori_ODC_ver20_DNAchainfix_PostPhenix.pdb (#1) |
| 8152 | | chain B; guessing termini instead |
| 8153 | | No usable SEQRES records for ARMori_ODC_ver20_DNAchainfix_PostPhenix.pdb (#1) |
| 8154 | | chain C; guessing termini instead |
| 8155 | | No usable SEQRES records for ARMori_ODC_ver20_DNAchainfix_PostPhenix.pdb (#1) |
| 8156 | | chain D; guessing termini instead |
| 8157 | | No usable SEQRES records for ARMori_ODC_ver20_DNAchainfix_PostPhenix.pdb (#1) |
| 8158 | | chain E; guessing termini instead |
| 8159 | | 4 messages similar to the above omitted |
| 8160 | | Chain-initial residues that are actual N termini: /A PRO 299, /B PRO 106, /C |
| 8161 | | THR 6, /D PRO 33, /E MET 1, /F PRO 179, /G PRO 93 |
| 8162 | | Chain-initial residues that are not actual N termini: /B VAL 396, /B VAL 444, |
| 8163 | | /B LYS 489, /C ASN 72, /D ASN 128, /D GLY 162, /D LEU 296, /D PHE 436, /E GLU |
| 8164 | | 217, /E ASP 319, /F SER 313, /G ALA 213, /G THR 386, /G VAL 439, /G ASN 461 |
| 8165 | | Chain-final residues that are actual C termini: /A LEU 718, /C LEU 685 |
| 8166 | | Chain-final residues that are not actual C termini: /B GLU 504, /B GLU 386, /B |
| 8167 | | HIS 420, /B VAL 479, /C ARG 29, /D ARG 510, /D SER 123, /D LEU 159, /D MET |
| 8168 | | 285, /D LEU 420, /E ASN 464, /E ALA 210, /E LEU 304, /F GLN 351, /F THR 307, |
| 8169 | | /G LEU 604, /G GLY 207, /G HIS 335, /G GLN 433, /G PHE 457 |
| 8170 | | 2714 hydrogen bonds |
| 8171 | | Adding 'H' to /B VAL 396 |
| 8172 | | Adding 'H' to /B VAL 444 |
| 8173 | | Adding 'H' to /B LYS 489 |
| 8174 | | Adding 'H' to /C ASN 72 |
| 8175 | | Adding 'H' to /D ASN 128 |
| 8176 | | 10 messages similar to the above omitted |
| 8177 | | /B GLU 504 is not terminus, removing H atom from 'C' |
| 8178 | | /D ARG 510 is not terminus, removing H atom from 'C' |
| 8179 | | /E ASN 464 is not terminus, removing H atom from 'C' |
| 8180 | | /F GLN 351 is not terminus, removing H atom from 'C' |
| 8181 | | /G LEU 604 is not terminus, removing H atom from 'C' |
| 8182 | | 24328 hydrogens added |
| 8183 | | |
| 8184 | | |
| 8185 | | > select clear |
| 8186 | | |
| 8187 | | > select nucleic |
| 8188 | | |
| 8189 | | 2158 atoms, 2326 bonds, 68 residues, 1 model selected |
| 8190 | | |
| 8191 | | > ui tool show H-Bonds |
| 8192 | | |
| 8193 | | > hbonds sel dashes 6 restrict #1/A,B,C,D,E,F,G angleSlop 40.0 twoColors true |
| 8194 | | > slopColor #ff9300 intraRes false select true reveal true retainCurrent true |
| 8195 | | > log true |
| 8196 | | |
| 8197 | | |
| 8198 | | Finding intermodel H-bonds |
| 8199 | | Finding intramodel H-bonds |
| 8200 | | Constraints relaxed by 0.4 angstroms and 40 degrees |
| 8201 | | Models used: |
| 8202 | | 1 ARMori_ODC_ver20_DNAchainfix_PostPhenix.pdb |
| 8203 | | |
| 8204 | | 49 H-bonds |
| 8205 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 8206 | | /A GLN 306 NE2 /I DG 53 O3' /A GLN 306 HE22 3.342 2.769 |
| 8207 | | /A ASN 436 ND2 /H DA 10 OP1 /A ASN 436 HD22 2.810 1.833 |
| 8208 | | /B LYS 148 NZ /I DA 28 OP1 /B LYS 148 HZ3 3.208 2.369 |
| 8209 | | /B LYS 279 N /I DA 48 OP1 /B LYS 279 H 3.110 2.192 |
| 8210 | | /C LYS 188 NZ /H DC 15 OP1 /C LYS 188 HZ1 3.176 2.193 |
| 8211 | | /C ARG 219 NH1 /I DT 49 OP2 /C ARG 219 HH11 3.015 2.053 |
| 8212 | | /C ARG 220 NH1 /H DT 13 O2 /C ARG 220 HH11 3.388 2.481 |
| 8213 | | /C ARG 220 NH1 /I DT 49 O2 /C ARG 220 HH11 3.296 2.935 |
| 8214 | | /C TYR 223 OH /H DC 15 OP1 /C TYR 223 HH 2.762 1.806 |
| 8215 | | /C TYR 607 OH /H DC 29 OP2 /C TYR 607 HH 3.098 2.200 |
| 8216 | | /C ARG 672 N /H DC 29 OP1 /C ARG 672 H 3.388 2.439 |
| 8217 | | /C ARG 672 NH1 /I DT 34 O2 /C ARG 672 HH12 2.806 1.902 |
| 8218 | | /C ARG 672 NH2 /I DT 34 O2 /C ARG 672 HH22 2.902 2.042 |
| 8219 | | /C ARG 672 NH2 /I DT 34 O4' /C ARG 672 HH22 3.185 2.472 |
| 8220 | | /C LYS 673 NZ /H DT 30 OP1 /C LYS 673 HZ1 3.030 2.116 |
| 8221 | | /D LYS 168 NZ /H DT 11 O2 /D LYS 168 HZ1 2.564 2.050 |
| 8222 | | /D SER 169 OG /H DA 12 OP1 /D SER 169 HG 3.284 2.325 |
| 8223 | | /D SER 463 OG /I DT 39 OP2 /D SER 463 HG 2.803 1.844 |
| 8224 | | /D LYS 465 NZ /I DG 40 N7 /D LYS 465 HZ1 3.514 2.654 |
| 8225 | | /D LYS 465 NZ /I DG 40 O6 /D LYS 465 HZ1 3.045 2.260 |
| 8226 | | /D LYS 465 NZ /I DG 41 O6 /D LYS 465 HZ2 3.189 2.368 |
| 8227 | | /E ARG 76 NH1 /H DG 14 OP1 /E ARG 76 HH11 2.908 2.005 |
| 8228 | | /E ARG 340 NH1 /I DA 28 OP2 /E ARG 340 HH11 3.135 2.272 |
| 8229 | | /E ARG 356 NH1 /I DT 27 OP2 /E ARG 356 HH11 2.946 2.163 |
| 8230 | | /E ARG 357 N /I DT 27 OP1 /E ARG 357 H 3.073 2.081 |
| 8231 | | /E ARG 357 NH1 /I DT 25 O2 /E ARG 357 HH12 2.761 1.945 |
| 8232 | | /E ARG 357 NH2 /I DT 25 O2 /E ARG 357 HH22 2.690 1.846 |
| 8233 | | /E GLU 358 N /H DG 38 OP1 /E GLU 358 H 3.275 2.276 |
| 8234 | | /E THR 359 OG1 /I DA 28 OP1 /E THR 359 HG1 2.552 1.830 |
| 8235 | | /E ARG 362 N /I DG 29 OP2 /E ARG 362 H 2.892 2.000 |
| 8236 | | /E ARG 362 NH1 /H DC 35 O4' /E ARG 362 HH12 3.369 2.780 |
| 8237 | | /E ARG 362 NH2 /H DC 35 O2 /E ARG 362 HH22 3.076 2.066 |
| 8238 | | /E ARG 362 NH2 /H DA 36 O4' /E ARG 362 HH21 3.065 2.496 |
| 8239 | | /E LYS 363 N /I DG 29 OP2 /E LYS 363 H 3.221 2.221 |
| 8240 | | /E LYS 363 NZ /I DG 30 OP1 /E LYS 363 HZ3 2.954 2.284 |
| 8241 | | /E LYS 363 NZ /I DG 30 OP2 /E LYS 363 HZ1 2.890 1.985 |
| 8242 | | /G GLY 546 N /H DT 24 OP1 /G GLY 546 H 3.276 2.580 |
| 8243 | | /G LYS 547 NZ /I DG 41 OP1 /G LYS 547 HZ1 3.303 2.294 |
| 8244 | | /G LYS 548 NZ /H DT 24 O2 /G LYS 548 HZ1 2.747 2.031 |
| 8245 | | /G LYS 548 NZ /H DC 25 O4' /G LYS 548 HZ2 2.889 2.196 |
| 8246 | | /G LYS 548 NZ /I DT 38 O2 /G LYS 548 HZ3 3.045 2.142 |
| 8247 | | /G ASN 553 N /I DG 41 OP2 /G ASN 553 H 3.220 2.217 |
| 8248 | | /G ARG 557 NH1 /I DG 44 N7 /G ARG 557 HH12 3.403 2.708 |
| 8249 | | /G ARG 557 NH1 /I DG 44 O6 /G ARG 557 HH12 2.566 1.988 |
| 8250 | | /G ARG 557 NH2 /I DG 44 N7 /G ARG 557 HH22 3.082 2.292 |
| 8251 | | /G LYS 560 NZ /H DA 12 OP2 /G LYS 560 HZ1 2.981 2.268 |
| 8252 | | /G GLY 561 N /H DT 13 OP1 /G GLY 561 H 2.977 2.057 |
| 8253 | | /G THR 563 N /H DT 13 OP2 /G THR 563 H 3.051 2.249 |
| 8254 | | /G ALA 565 N /H DG 14 OP2 /G ALA 565 H 3.032 2.059 |
| 8255 | | |
| 8256 | | |
| 8257 | | |
| 8258 | | 49 hydrogen bonds found |
| 8259 | | 8 strict hydrogen bonds found |
| 8260 | | |
| 8261 | | > select clear |
| 8262 | | |
| 8263 | | > hide atoms |
| 8264 | | |
| 8265 | | > select nucleic |
| 8266 | | |
| 8267 | | 2158 atoms, 2326 bonds, 68 residues, 1 model selected |
| 8268 | | |
| 8269 | | > show sel atoms |
| 8270 | | |
| 8271 | | > hbonds sel saveFile "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 8272 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 8273 | | > structures/PDBs/ylODC_oriA006_complete/hbond_oriA_generation_ver20_relaxed40" |
| 8274 | | > restrict #1/A,B,C,D,E,F,G angleSlop 40.0 twoColors true slopColor #ff9300 |
| 8275 | | > intraRes false select true reveal true log true |
| 8276 | | |
| 8277 | | |
| 8278 | | Finding intermodel H-bonds |
| 8279 | | Finding intramodel H-bonds |
| 8280 | | Constraints relaxed by 0.4 angstroms and 40 degrees |
| 8281 | | Models used: |
| 8282 | | 1 ARMori_ODC_ver20_DNAchainfix_PostPhenix.pdb |
| 8283 | | |
| 8284 | | 49 H-bonds |
| 8285 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 8286 | | /A GLN 306 NE2 /I DG 53 O3' /A GLN 306 HE22 3.342 2.769 |
| 8287 | | /A ASN 436 ND2 /H DA 10 OP1 /A ASN 436 HD22 2.810 1.833 |
| 8288 | | /B LYS 148 NZ /I DA 28 OP1 /B LYS 148 HZ3 3.208 2.369 |
| 8289 | | /B LYS 279 N /I DA 48 OP1 /B LYS 279 H 3.110 2.192 |
| 8290 | | /C LYS 188 NZ /H DC 15 OP1 /C LYS 188 HZ1 3.176 2.193 |
| 8291 | | /C ARG 219 NH1 /I DT 49 OP2 /C ARG 219 HH11 3.015 2.053 |
| 8292 | | /C ARG 220 NH1 /H DT 13 O2 /C ARG 220 HH11 3.388 2.481 |
| 8293 | | /C ARG 220 NH1 /I DT 49 O2 /C ARG 220 HH11 3.296 2.935 |
| 8294 | | /C TYR 223 OH /H DC 15 OP1 /C TYR 223 HH 2.762 1.806 |
| 8295 | | /C TYR 607 OH /H DC 29 OP2 /C TYR 607 HH 3.098 2.200 |
| 8296 | | /C ARG 672 N /H DC 29 OP1 /C ARG 672 H 3.388 2.439 |
| 8297 | | /C ARG 672 NH1 /I DT 34 O2 /C ARG 672 HH12 2.806 1.902 |
| 8298 | | /C ARG 672 NH2 /I DT 34 O2 /C ARG 672 HH22 2.902 2.042 |
| 8299 | | /C ARG 672 NH2 /I DT 34 O4' /C ARG 672 HH22 3.185 2.472 |
| 8300 | | /C LYS 673 NZ /H DT 30 OP1 /C LYS 673 HZ1 3.030 2.116 |
| 8301 | | /D LYS 168 NZ /H DT 11 O2 /D LYS 168 HZ1 2.564 2.050 |
| 8302 | | /D SER 169 OG /H DA 12 OP1 /D SER 169 HG 3.284 2.325 |
| 8303 | | /D SER 463 OG /I DT 39 OP2 /D SER 463 HG 2.803 1.844 |
| 8304 | | /D LYS 465 NZ /I DG 40 N7 /D LYS 465 HZ1 3.514 2.654 |
| 8305 | | /D LYS 465 NZ /I DG 40 O6 /D LYS 465 HZ1 3.045 2.260 |
| 8306 | | /D LYS 465 NZ /I DG 41 O6 /D LYS 465 HZ2 3.189 2.368 |
| 8307 | | /E ARG 76 NH1 /H DG 14 OP1 /E ARG 76 HH11 2.908 2.005 |
| 8308 | | /E ARG 340 NH1 /I DA 28 OP2 /E ARG 340 HH11 3.135 2.272 |
| 8309 | | /E ARG 356 NH1 /I DT 27 OP2 /E ARG 356 HH11 2.946 2.163 |
| 8310 | | /E ARG 357 N /I DT 27 OP1 /E ARG 357 H 3.073 2.081 |
| 8311 | | /E ARG 357 NH1 /I DT 25 O2 /E ARG 357 HH12 2.761 1.945 |
| 8312 | | /E ARG 357 NH2 /I DT 25 O2 /E ARG 357 HH22 2.690 1.846 |
| 8313 | | /E GLU 358 N /H DG 38 OP1 /E GLU 358 H 3.275 2.276 |
| 8314 | | /E THR 359 OG1 /I DA 28 OP1 /E THR 359 HG1 2.552 1.830 |
| 8315 | | /E ARG 362 N /I DG 29 OP2 /E ARG 362 H 2.892 2.000 |
| 8316 | | /E ARG 362 NH1 /H DC 35 O4' /E ARG 362 HH12 3.369 2.780 |
| 8317 | | /E ARG 362 NH2 /H DC 35 O2 /E ARG 362 HH22 3.076 2.066 |
| 8318 | | /E ARG 362 NH2 /H DA 36 O4' /E ARG 362 HH21 3.065 2.496 |
| 8319 | | /E LYS 363 N /I DG 29 OP2 /E LYS 363 H 3.221 2.221 |
| 8320 | | /E LYS 363 NZ /I DG 30 OP1 /E LYS 363 HZ3 2.954 2.284 |
| 8321 | | /E LYS 363 NZ /I DG 30 OP2 /E LYS 363 HZ1 2.890 1.985 |
| 8322 | | /G GLY 546 N /H DT 24 OP1 /G GLY 546 H 3.276 2.580 |
| 8323 | | /G LYS 547 NZ /I DG 41 OP1 /G LYS 547 HZ1 3.303 2.294 |
| 8324 | | /G LYS 548 NZ /H DT 24 O2 /G LYS 548 HZ1 2.747 2.031 |
| 8325 | | /G LYS 548 NZ /H DC 25 O4' /G LYS 548 HZ2 2.889 2.196 |
| 8326 | | /G LYS 548 NZ /I DT 38 O2 /G LYS 548 HZ3 3.045 2.142 |
| 8327 | | /G ASN 553 N /I DG 41 OP2 /G ASN 553 H 3.220 2.217 |
| 8328 | | /G ARG 557 NH1 /I DG 44 N7 /G ARG 557 HH12 3.403 2.708 |
| 8329 | | /G ARG 557 NH1 /I DG 44 O6 /G ARG 557 HH12 2.566 1.988 |
| 8330 | | /G ARG 557 NH2 /I DG 44 N7 /G ARG 557 HH22 3.082 2.292 |
| 8331 | | /G LYS 560 NZ /H DA 12 OP2 /G LYS 560 HZ1 2.981 2.268 |
| 8332 | | /G GLY 561 N /H DT 13 OP1 /G GLY 561 H 2.977 2.057 |
| 8333 | | /G THR 563 N /H DT 13 OP2 /G THR 563 H 3.051 2.249 |
| 8334 | | /G ALA 565 N /H DG 14 OP2 /G ALA 565 H 3.032 2.059 |
| 8335 | | |
| 8336 | | |
| 8337 | | |
| 8338 | | 49 hydrogen bonds found |
| 8339 | | 8 strict hydrogen bonds found |
| 8340 | | |
| 8341 | | > select up |
| 8342 | | |
| 8343 | | 1476 atoms, 1511 bonds, 59 residues, 1 model selected |
| 8344 | | |
| 8345 | | > show sel atoms |
| 8346 | | |
| 8347 | | > select nucleic |
| 8348 | | |
| 8349 | | 2158 atoms, 2326 bonds, 68 residues, 1 model selected |
| 8350 | | |
| 8351 | | > select nucleic |
| 8352 | | |
| 8353 | | 2158 atoms, 2326 bonds, 68 residues, 1 model selected |
| 8354 | | |
| 8355 | | > hbonds sel saveFile "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 8356 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 8357 | | > structures/PDBs/ylODC_oriA006_complete/hbond_oriA_generation_ver20" dashes 6 |
| 8358 | | > restrict #1/A,B,C,D,E,F,G twoColors true slopColor #00f900 intraRes false |
| 8359 | | > select true reveal true retainCurrent true log true |
| 8360 | | |
| 8361 | | |
| 8362 | | Finding intermodel H-bonds |
| 8363 | | Finding intramodel H-bonds |
| 8364 | | Constraints relaxed by 0.4 angstroms and 20 degrees |
| 8365 | | Models used: |
| 8366 | | 1 ARMori_ODC_ver20_DNAchainfix_PostPhenix.pdb |
| 8367 | | |
| 8368 | | 39 H-bonds |
| 8369 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 8370 | | /A ASN 436 ND2 /H DA 10 OP1 /A ASN 436 HD22 2.810 1.833 |
| 8371 | | /B LYS 148 NZ /I DA 28 OP1 /B LYS 148 HZ3 3.208 2.369 |
| 8372 | | /B LYS 279 N /I DA 48 OP1 /B LYS 279 H 3.110 2.192 |
| 8373 | | /C LYS 188 NZ /H DC 15 OP1 /C LYS 188 HZ1 3.176 2.193 |
| 8374 | | /C ARG 219 NH1 /I DT 49 OP2 /C ARG 219 HH11 3.015 2.053 |
| 8375 | | /C ARG 220 NH1 /H DT 13 O2 /C ARG 220 HH11 3.388 2.481 |
| 8376 | | /C TYR 223 OH /H DC 15 OP1 /C TYR 223 HH 2.762 1.806 |
| 8377 | | /C TYR 607 OH /H DC 29 OP2 /C TYR 607 HH 3.098 2.200 |
| 8378 | | /C ARG 672 N /H DC 29 OP1 /C ARG 672 H 3.388 2.439 |
| 8379 | | /C ARG 672 NH1 /I DT 34 O2 /C ARG 672 HH12 2.806 1.902 |
| 8380 | | /C ARG 672 NH2 /I DT 34 O2 /C ARG 672 HH22 2.902 2.042 |
| 8381 | | /C ARG 672 NH2 /I DT 34 O4' /C ARG 672 HH22 3.185 2.472 |
| 8382 | | /C LYS 673 NZ /H DT 30 OP1 /C LYS 673 HZ1 3.030 2.116 |
| 8383 | | /D SER 169 OG /H DA 12 OP1 /D SER 169 HG 3.284 2.325 |
| 8384 | | /D SER 463 OG /I DT 39 OP2 /D SER 463 HG 2.803 1.844 |
| 8385 | | /D LYS 465 NZ /I DG 40 N7 /D LYS 465 HZ1 3.514 2.654 |
| 8386 | | /D LYS 465 NZ /I DG 40 O6 /D LYS 465 HZ1 3.045 2.260 |
| 8387 | | /D LYS 465 NZ /I DG 41 O6 /D LYS 465 HZ2 3.189 2.368 |
| 8388 | | /E ARG 76 NH1 /H DG 14 OP1 /E ARG 76 HH11 2.908 2.005 |
| 8389 | | /E ARG 340 NH1 /I DA 28 OP2 /E ARG 340 HH11 3.135 2.272 |
| 8390 | | /E ARG 356 NH1 /I DT 27 OP2 /E ARG 356 HH11 2.946 2.163 |
| 8391 | | /E ARG 357 N /I DT 27 OP1 /E ARG 357 H 3.073 2.081 |
| 8392 | | /E ARG 357 NH1 /I DT 25 O2 /E ARG 357 HH12 2.761 1.945 |
| 8393 | | /E ARG 357 NH2 /I DT 25 O2 /E ARG 357 HH22 2.690 1.846 |
| 8394 | | /E GLU 358 N /H DG 38 OP1 /E GLU 358 H 3.275 2.276 |
| 8395 | | /E THR 359 OG1 /I DA 28 OP1 /E THR 359 HG1 2.552 1.830 |
| 8396 | | /E ARG 362 N /I DG 29 OP2 /E ARG 362 H 2.892 2.000 |
| 8397 | | /E ARG 362 NH2 /H DC 35 O2 /E ARG 362 HH22 3.076 2.066 |
| 8398 | | /E LYS 363 N /I DG 29 OP2 /E LYS 363 H 3.221 2.221 |
| 8399 | | /E LYS 363 NZ /I DG 30 OP2 /E LYS 363 HZ1 2.890 1.985 |
| 8400 | | /G LYS 547 NZ /I DG 41 OP1 /G LYS 547 HZ1 3.303 2.294 |
| 8401 | | /G LYS 548 NZ /H DT 24 O2 /G LYS 548 HZ1 2.747 2.031 |
| 8402 | | /G LYS 548 NZ /I DT 38 O2 /G LYS 548 HZ3 3.045 2.142 |
| 8403 | | /G ASN 553 N /I DG 41 OP2 /G ASN 553 H 3.220 2.217 |
| 8404 | | /G ARG 557 NH1 /I DG 44 N7 /G ARG 557 HH12 3.403 2.708 |
| 8405 | | /G ARG 557 NH2 /I DG 44 N7 /G ARG 557 HH22 3.082 2.292 |
| 8406 | | /G GLY 561 N /H DT 13 OP1 /G GLY 561 H 2.977 2.057 |
| 8407 | | /G THR 563 N /H DT 13 OP2 /G THR 563 H 3.051 2.249 |
| 8408 | | /G ALA 565 N /H DG 14 OP2 /G ALA 565 H 3.032 2.059 |
| 8409 | | |
| 8410 | | |
| 8411 | | |
| 8412 | | 39 hydrogen bonds found |
| 8413 | | 8 strict hydrogen bonds found |
| 8414 | | |
| 8415 | | > select clear |
| 8416 | | |
| 8417 | | > select /I:38 |
| 8418 | | |
| 8419 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 8420 | | |
| 8421 | | > select /H:23 |
| 8422 | | |
| 8423 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 8424 | | |
| 8425 | | > ui tool show "Renumber Residues" |
| 8426 | | |
| 8427 | | > renumber /H start -18 |
| 8428 | | |
| 8429 | | 34 residues renumbered |
| 8430 | | |
| 8431 | | > renumber /H start -17 |
| 8432 | | |
| 8433 | | 34 residues renumbered |
| 8434 | | |
| 8435 | | > select /I:39 |
| 8436 | | |
| 8437 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 8438 | | |
| 8439 | | > select /I:38 |
| 8440 | | |
| 8441 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 8442 | | |
| 8443 | | > renumber /I start -16 |
| 8444 | | |
| 8445 | | 34 residues renumbered |
| 8446 | | |
| 8447 | | > select /H |
| 8448 | | |
| 8449 | | 1060 atoms, 1139 bonds, 34 residues, 1 model selected |
| 8450 | | |
| 8451 | | > ui tool show "Change Chain IDs" |
| 8452 | | |
| 8453 | | > changechains sel main |
| 8454 | | |
| 8455 | | Chain IDs of 34 residues changed |
| 8456 | | |
| 8457 | | > select /I |
| 8458 | | |
| 8459 | | 1098 atoms, 1187 bonds, 34 residues, 1 model selected |
| 8460 | | |
| 8461 | | > changechains sel opp |
| 8462 | | |
| 8463 | | Chain IDs of 34 residues changed |
| 8464 | | |
| 8465 | | > select clear |
| 8466 | | |
| 8467 | | > select nucleic |
| 8468 | | |
| 8469 | | 2158 atoms, 2326 bonds, 68 residues, 1 model selected |
| 8470 | | |
| 8471 | | > hbonds sel saveFile "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 8472 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 8473 | | > structures/PDBs/ylODC_oriA006_complete/hbond_oriA_generation_ver20_relaxed40" |
| 8474 | | > dashes 6 restrict #1/A,B,C,D,E,F,G angleSlop 40.0 twoColors true slopColor |
| 8475 | | > #ff9300 intraRes false select true reveal true retainCurrent true log true |
| 8476 | | |
| 8477 | | |
| 8478 | | Finding intermodel H-bonds |
| 8479 | | Finding intramodel H-bonds |
| 8480 | | Constraints relaxed by 0.4 angstroms and 40 degrees |
| 8481 | | Models used: |
| 8482 | | 1 ARMori_ODC_ver20_DNAchainfix_PostPhenix.pdb |
| 8483 | | |
| 8484 | | 49 H-bonds |
| 8485 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 8486 | | /A GLN 306 NE2 /opp DG 15 O3' /A GLN 306 HE22 3.342 2.769 |
| 8487 | | /A ASN 436 ND2 /main DA -13 OP1 /A ASN 436 HD22 2.810 1.833 |
| 8488 | | /B LYS 148 NZ /opp DA -10 OP1 /B LYS 148 HZ3 3.208 2.369 |
| 8489 | | /B LYS 279 N /opp DA 10 OP1 /B LYS 279 H 3.110 2.192 |
| 8490 | | /C LYS 188 NZ /main DC -8 OP1 /C LYS 188 HZ1 3.176 2.193 |
| 8491 | | /C ARG 219 NH1 /opp DT 11 OP2 /C ARG 219 HH11 3.015 2.053 |
| 8492 | | /C ARG 220 NH1 /main DT -10 O2 /C ARG 220 HH11 3.388 2.481 |
| 8493 | | /C ARG 220 NH1 /opp DT 11 O2 /C ARG 220 HH11 3.296 2.935 |
| 8494 | | /C TYR 223 OH /main DC -8 OP1 /C TYR 223 HH 2.762 1.806 |
| 8495 | | /C TYR 607 OH /main DC 6 OP2 /C TYR 607 HH 3.098 2.200 |
| 8496 | | /C ARG 672 N /main DC 6 OP1 /C ARG 672 H 3.388 2.439 |
| 8497 | | /C ARG 672 NH1 /opp DT -4 O2 /C ARG 672 HH12 2.806 1.902 |
| 8498 | | /C ARG 672 NH2 /opp DT -4 O2 /C ARG 672 HH22 2.902 2.042 |
| 8499 | | /C ARG 672 NH2 /opp DT -4 O4' /C ARG 672 HH22 3.185 2.472 |
| 8500 | | /C LYS 673 NZ /main DT 7 OP1 /C LYS 673 HZ1 3.030 2.116 |
| 8501 | | /D LYS 168 NZ /main DT -12 O2 /D LYS 168 HZ1 2.564 2.050 |
| 8502 | | /D SER 169 OG /main DA -11 OP1 /D SER 169 HG 3.284 2.325 |
| 8503 | | /D SER 463 OG /opp DT 1 OP2 /D SER 463 HG 2.803 1.844 |
| 8504 | | /D LYS 465 NZ /opp DG 2 N7 /D LYS 465 HZ1 3.514 2.654 |
| 8505 | | /D LYS 465 NZ /opp DG 2 O6 /D LYS 465 HZ1 3.045 2.260 |
| 8506 | | /D LYS 465 NZ /opp DG 3 O6 /D LYS 465 HZ2 3.189 2.368 |
| 8507 | | /E ARG 76 NH1 /main DG -9 OP1 /E ARG 76 HH11 2.908 2.005 |
| 8508 | | /E ARG 340 NH1 /opp DA -10 OP2 /E ARG 340 HH11 3.135 2.272 |
| 8509 | | /E ARG 356 NH1 /opp DT -11 OP2 /E ARG 356 HH11 2.946 2.163 |
| 8510 | | /E ARG 357 N /opp DT -11 OP1 /E ARG 357 H 3.073 2.081 |
| 8511 | | /E ARG 357 NH1 /opp DT -13 O2 /E ARG 357 HH12 2.761 1.945 |
| 8512 | | /E ARG 357 NH2 /opp DT -13 O2 /E ARG 357 HH22 2.690 1.846 |
| 8513 | | /E GLU 358 N /main DG 15 OP1 /E GLU 358 H 3.275 2.276 |
| 8514 | | /E THR 359 OG1 /opp DA -10 OP1 /E THR 359 HG1 2.552 1.830 |
| 8515 | | /E ARG 362 N /opp DG -9 OP2 /E ARG 362 H 2.892 2.000 |
| 8516 | | /E ARG 362 NH1 /main DC 12 O4' /E ARG 362 HH12 3.369 2.780 |
| 8517 | | /E ARG 362 NH2 /main DC 12 O2 /E ARG 362 HH22 3.076 2.066 |
| 8518 | | /E ARG 362 NH2 /main DA 13 O4' /E ARG 362 HH21 3.065 2.496 |
| 8519 | | /E LYS 363 N /opp DG -9 OP2 /E LYS 363 H 3.221 2.221 |
| 8520 | | /E LYS 363 NZ /opp DG -8 OP1 /E LYS 363 HZ3 2.954 2.284 |
| 8521 | | /E LYS 363 NZ /opp DG -8 OP2 /E LYS 363 HZ1 2.890 1.985 |
| 8522 | | /G GLY 546 N /main DT 1 OP1 /G GLY 546 H 3.276 2.580 |
| 8523 | | /G LYS 547 NZ /opp DG 3 OP1 /G LYS 547 HZ1 3.303 2.294 |
| 8524 | | /G LYS 548 NZ /main DT 1 O2 /G LYS 548 HZ1 2.747 2.031 |
| 8525 | | /G LYS 548 NZ /main DC 2 O4' /G LYS 548 HZ2 2.889 2.196 |
| 8526 | | /G LYS 548 NZ /opp DT 0 O2 /G LYS 548 HZ3 3.045 2.142 |
| 8527 | | /G ASN 553 N /opp DG 3 OP2 /G ASN 553 H 3.220 2.217 |
| 8528 | | /G ARG 557 NH1 /opp DG 6 N7 /G ARG 557 HH12 3.403 2.708 |
| 8529 | | /G ARG 557 NH1 /opp DG 6 O6 /G ARG 557 HH12 2.566 1.988 |
| 8530 | | /G ARG 557 NH2 /opp DG 6 N7 /G ARG 557 HH22 3.082 2.292 |
| 8531 | | /G LYS 560 NZ /main DA -11 OP2 /G LYS 560 HZ1 2.981 2.268 |
| 8532 | | /G GLY 561 N /main DT -10 OP1 /G GLY 561 H 2.977 2.057 |
| 8533 | | /G THR 563 N /main DT -10 OP2 /G THR 563 H 3.051 2.249 |
| 8534 | | /G ALA 565 N /main DG -9 OP2 /G ALA 565 H 3.032 2.059 |
| 8535 | | |
| 8536 | | |
| 8537 | | |
| 8538 | | 49 hydrogen bonds found |
| 8539 | | 8 strict hydrogen bonds found |
| 8540 | | |
| 8541 | | > select nucleic |
| 8542 | | |
| 8543 | | 2158 atoms, 2326 bonds, 68 residues, 1 model selected |
| 8544 | | |
| 8545 | | > hbonds sel saveFile "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 8546 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 8547 | | > structures/PDBs/ylODC_oriA006_complete/hbond_oriA_generation_ver20" dashes 6 |
| 8548 | | > restrict #1/A,B,C,D,E,F,G twoColors true slopColor #00f900 intraRes false |
| 8549 | | > select true reveal true retainCurrent true log true |
| 8550 | | |
| 8551 | | |
| 8552 | | Finding intermodel H-bonds |
| 8553 | | Finding intramodel H-bonds |
| 8554 | | Constraints relaxed by 0.4 angstroms and 20 degrees |
| 8555 | | Models used: |
| 8556 | | 1 ARMori_ODC_ver20_DNAchainfix_PostPhenix.pdb |
| 8557 | | |
| 8558 | | 39 H-bonds |
| 8559 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 8560 | | /A ASN 436 ND2 /main DA -13 OP1 /A ASN 436 HD22 2.810 1.833 |
| 8561 | | /B LYS 148 NZ /opp DA -10 OP1 /B LYS 148 HZ3 3.208 2.369 |
| 8562 | | /B LYS 279 N /opp DA 10 OP1 /B LYS 279 H 3.110 2.192 |
| 8563 | | /C LYS 188 NZ /main DC -8 OP1 /C LYS 188 HZ1 3.176 2.193 |
| 8564 | | /C ARG 219 NH1 /opp DT 11 OP2 /C ARG 219 HH11 3.015 2.053 |
| 8565 | | /C ARG 220 NH1 /main DT -10 O2 /C ARG 220 HH11 3.388 2.481 |
| 8566 | | /C TYR 223 OH /main DC -8 OP1 /C TYR 223 HH 2.762 1.806 |
| 8567 | | /C TYR 607 OH /main DC 6 OP2 /C TYR 607 HH 3.098 2.200 |
| 8568 | | /C ARG 672 N /main DC 6 OP1 /C ARG 672 H 3.388 2.439 |
| 8569 | | /C ARG 672 NH1 /opp DT -4 O2 /C ARG 672 HH12 2.806 1.902 |
| 8570 | | /C ARG 672 NH2 /opp DT -4 O2 /C ARG 672 HH22 2.902 2.042 |
| 8571 | | /C ARG 672 NH2 /opp DT -4 O4' /C ARG 672 HH22 3.185 2.472 |
| 8572 | | /C LYS 673 NZ /main DT 7 OP1 /C LYS 673 HZ1 3.030 2.116 |
| 8573 | | /D SER 169 OG /main DA -11 OP1 /D SER 169 HG 3.284 2.325 |
| 8574 | | /D SER 463 OG /opp DT 1 OP2 /D SER 463 HG 2.803 1.844 |
| 8575 | | /D LYS 465 NZ /opp DG 2 N7 /D LYS 465 HZ1 3.514 2.654 |
| 8576 | | /D LYS 465 NZ /opp DG 2 O6 /D LYS 465 HZ1 3.045 2.260 |
| 8577 | | /D LYS 465 NZ /opp DG 3 O6 /D LYS 465 HZ2 3.189 2.368 |
| 8578 | | /E ARG 76 NH1 /main DG -9 OP1 /E ARG 76 HH11 2.908 2.005 |
| 8579 | | /E ARG 340 NH1 /opp DA -10 OP2 /E ARG 340 HH11 3.135 2.272 |
| 8580 | | /E ARG 356 NH1 /opp DT -11 OP2 /E ARG 356 HH11 2.946 2.163 |
| 8581 | | /E ARG 357 N /opp DT -11 OP1 /E ARG 357 H 3.073 2.081 |
| 8582 | | /E ARG 357 NH1 /opp DT -13 O2 /E ARG 357 HH12 2.761 1.945 |
| 8583 | | /E ARG 357 NH2 /opp DT -13 O2 /E ARG 357 HH22 2.690 1.846 |
| 8584 | | /E GLU 358 N /main DG 15 OP1 /E GLU 358 H 3.275 2.276 |
| 8585 | | /E THR 359 OG1 /opp DA -10 OP1 /E THR 359 HG1 2.552 1.830 |
| 8586 | | /E ARG 362 N /opp DG -9 OP2 /E ARG 362 H 2.892 2.000 |
| 8587 | | /E ARG 362 NH2 /main DC 12 O2 /E ARG 362 HH22 3.076 2.066 |
| 8588 | | /E LYS 363 N /opp DG -9 OP2 /E LYS 363 H 3.221 2.221 |
| 8589 | | /E LYS 363 NZ /opp DG -8 OP2 /E LYS 363 HZ1 2.890 1.985 |
| 8590 | | /G LYS 547 NZ /opp DG 3 OP1 /G LYS 547 HZ1 3.303 2.294 |
| 8591 | | /G LYS 548 NZ /main DT 1 O2 /G LYS 548 HZ1 2.747 2.031 |
| 8592 | | /G LYS 548 NZ /opp DT 0 O2 /G LYS 548 HZ3 3.045 2.142 |
| 8593 | | /G ASN 553 N /opp DG 3 OP2 /G ASN 553 H 3.220 2.217 |
| 8594 | | /G ARG 557 NH1 /opp DG 6 N7 /G ARG 557 HH12 3.403 2.708 |
| 8595 | | /G ARG 557 NH2 /opp DG 6 N7 /G ARG 557 HH22 3.082 2.292 |
| 8596 | | /G GLY 561 N /main DT -10 OP1 /G GLY 561 H 2.977 2.057 |
| 8597 | | /G THR 563 N /main DT -10 OP2 /G THR 563 H 3.051 2.249 |
| 8598 | | /G ALA 565 N /main DG -9 OP2 /G ALA 565 H 3.032 2.059 |
| 8599 | | |
| 8600 | | |
| 8601 | | |
| 8602 | | 39 hydrogen bonds found |
| 8603 | | 8 strict hydrogen bonds found |
| 8604 | | |
| 8605 | | > select clear |
| 8606 | | |
| 8607 | | > save "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 8608 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 8609 | | > structures/PDBs/ylODC_oriA006_complete/hbond_oriA_ver20.cxs" |
| 8610 | | |
| 8611 | | > select /A:303 |
| 8612 | | |
| 8613 | | 20 atoms, 20 bonds, 1 residue, 1 model selected |
| 8614 | | |
| 8615 | | > show sel atoms |
| 8616 | | |
| 8617 | | > select /main:-13 |
| 8618 | | |
| 8619 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 8620 | | |
| 8621 | | > hide sel cartoons |
| 8622 | | |
| 8623 | | > select nucleic |
| 8624 | | |
| 8625 | | 2158 atoms, 2326 bonds, 68 residues, 1 model selected |
| 8626 | | |
| 8627 | | > hbonds sel saveFile "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 8628 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 8629 | | > structures/PDBs/ylODC_oriA006_complete/hbond_oriA_generation_ver20_relaxed40" |
| 8630 | | > dashes 6 restrict #1/A,B,C,D,E,F,G distSlop 0.5 angleSlop 40.0 twoColors |
| 8631 | | > true slopColor #ff9300 intraRes false select true reveal true retainCurrent |
| 8632 | | > true log true |
| 8633 | | |
| 8634 | | |
| 8635 | | Finding intermodel H-bonds |
| 8636 | | Finding intramodel H-bonds |
| 8637 | | Constraints relaxed by 0.5 angstroms and 40 degrees |
| 8638 | | Models used: |
| 8639 | | 1 ARMori_ODC_ver20_DNAchainfix_PostPhenix.pdb |
| 8640 | | |
| 8641 | | 53 H-bonds |
| 8642 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 8643 | | /A GLN 306 NE2 /opp DG 15 O3' /A GLN 306 HE22 3.342 2.769 |
| 8644 | | /A ASN 436 ND2 /main DA -13 OP1 /A ASN 436 HD22 2.810 1.833 |
| 8645 | | /B LYS 148 NZ /opp DA -10 OP1 /B LYS 148 HZ3 3.208 2.369 |
| 8646 | | /B LYS 279 N /opp DA 10 OP1 /B LYS 279 H 3.110 2.192 |
| 8647 | | /C LYS 188 NZ /main DC -8 OP1 /C LYS 188 HZ1 3.176 2.193 |
| 8648 | | /C ARG 219 N /opp DA 12 OP1 /C ARG 219 H 3.467 2.499 |
| 8649 | | /C ARG 219 NH1 /opp DT 11 OP2 /C ARG 219 HH11 3.015 2.053 |
| 8650 | | /C ARG 220 NH1 /main DT -10 O2 /C ARG 220 HH11 3.388 2.481 |
| 8651 | | /C ARG 220 NH1 /opp DT 11 O2 /C ARG 220 HH11 3.296 2.935 |
| 8652 | | /C TYR 223 OH /main DG -9 O3' /C TYR 223 HH 3.522 2.887 |
| 8653 | | /C TYR 223 OH /main DC -8 OP1 /C TYR 223 HH 2.762 1.806 |
| 8654 | | /C TYR 607 OH /main DC 6 OP2 /C TYR 607 HH 3.098 2.200 |
| 8655 | | /C LYS 671 N /main DC 6 OP1 /C LYS 671 H 3.429 2.701 |
| 8656 | | /C ARG 672 N /main DC 6 OP1 /C ARG 672 H 3.388 2.439 |
| 8657 | | /C ARG 672 NH1 /opp DT -4 O2 /C ARG 672 HH12 2.806 1.902 |
| 8658 | | /C ARG 672 NH2 /opp DT -4 O2 /C ARG 672 HH22 2.902 2.042 |
| 8659 | | /C ARG 672 NH2 /opp DT -4 O4' /C ARG 672 HH22 3.185 2.472 |
| 8660 | | /C LYS 673 NZ /main DT 7 OP1 /C LYS 673 HZ1 3.030 2.116 |
| 8661 | | /D LYS 168 NZ /main DT -12 O2 /D LYS 168 HZ1 2.564 2.050 |
| 8662 | | /D SER 169 OG /main DA -11 OP1 /D SER 169 HG 3.284 2.325 |
| 8663 | | /D SER 463 OG /opp DT 1 OP2 /D SER 463 HG 2.803 1.844 |
| 8664 | | /D LYS 465 NZ /opp DG 2 N7 /D LYS 465 HZ1 3.514 2.654 |
| 8665 | | /D LYS 465 NZ /opp DG 2 O6 /D LYS 465 HZ1 3.045 2.260 |
| 8666 | | /D LYS 465 NZ /opp DG 3 O6 /D LYS 465 HZ2 3.189 2.368 |
| 8667 | | /E ARG 76 NH1 /main DG -9 OP1 /E ARG 76 HH11 2.908 2.005 |
| 8668 | | /E ARG 340 NH1 /opp DA -10 OP2 /E ARG 340 HH11 3.135 2.272 |
| 8669 | | /E ARG 356 NH1 /opp DT -11 OP2 /E ARG 356 HH11 2.946 2.163 |
| 8670 | | /E ARG 357 N /opp DT -11 OP1 /E ARG 357 H 3.073 2.081 |
| 8671 | | /E ARG 357 NH1 /opp DT -13 O2 /E ARG 357 HH12 2.761 1.945 |
| 8672 | | /E ARG 357 NH2 /opp DT -13 O2 /E ARG 357 HH22 2.690 1.846 |
| 8673 | | /E GLU 358 N /main DG 15 OP1 /E GLU 358 H 3.275 2.276 |
| 8674 | | /E THR 359 OG1 /opp DA -10 OP1 /E THR 359 HG1 2.552 1.830 |
| 8675 | | /E ARG 362 N /opp DA -10 O3' /E ARG 362 H 3.515 2.618 |
| 8676 | | /E ARG 362 N /opp DG -9 OP2 /E ARG 362 H 2.892 2.000 |
| 8677 | | /E ARG 362 NH1 /main DC 12 O4' /E ARG 362 HH12 3.369 2.780 |
| 8678 | | /E ARG 362 NH2 /main DC 12 O2 /E ARG 362 HH22 3.076 2.066 |
| 8679 | | /E ARG 362 NH2 /main DA 13 O4' /E ARG 362 HH21 3.065 2.496 |
| 8680 | | /E LYS 363 N /opp DG -9 OP2 /E LYS 363 H 3.221 2.221 |
| 8681 | | /E LYS 363 NZ /opp DG -8 OP1 /E LYS 363 HZ3 2.954 2.284 |
| 8682 | | /E LYS 363 NZ /opp DG -8 OP2 /E LYS 363 HZ1 2.890 1.985 |
| 8683 | | /G GLY 546 N /main DT 1 OP1 /G GLY 546 H 3.276 2.580 |
| 8684 | | /G LYS 547 NZ /opp DG 3 OP1 /G LYS 547 HZ1 3.303 2.294 |
| 8685 | | /G LYS 548 NZ /main DT 1 O2 /G LYS 548 HZ1 2.747 2.031 |
| 8686 | | /G LYS 548 NZ /main DC 2 O4' /G LYS 548 HZ2 2.889 2.196 |
| 8687 | | /G LYS 548 NZ /opp DT 0 O2 /G LYS 548 HZ3 3.045 2.142 |
| 8688 | | /G ASN 553 N /opp DG 3 OP2 /G ASN 553 H 3.220 2.217 |
| 8689 | | /G ARG 557 NH1 /opp DG 6 N7 /G ARG 557 HH12 3.403 2.708 |
| 8690 | | /G ARG 557 NH1 /opp DG 6 O6 /G ARG 557 HH12 2.566 1.988 |
| 8691 | | /G ARG 557 NH2 /opp DG 6 N7 /G ARG 557 HH22 3.082 2.292 |
| 8692 | | /G LYS 560 NZ /main DA -11 OP2 /G LYS 560 HZ1 2.981 2.268 |
| 8693 | | /G GLY 561 N /main DT -10 OP1 /G GLY 561 H 2.977 2.057 |
| 8694 | | /G THR 563 N /main DT -10 OP2 /G THR 563 H 3.051 2.249 |
| 8695 | | /G ALA 565 N /main DG -9 OP2 /G ALA 565 H 3.032 2.059 |
| 8696 | | |
| 8697 | | |
| 8698 | | |
| 8699 | | 53 hydrogen bonds found |
| 8700 | | 8 strict hydrogen bonds found |
| 8701 | | |
| 8702 | | > select up |
| 8703 | | |
| 8704 | | 1530 atoms, 1568 bonds, 61 residues, 1 model selected |
| 8705 | | |
| 8706 | | > show sel atoms |
| 8707 | | |
| 8708 | | > select clear |
| 8709 | | |
| 8710 | | > select nucleic |
| 8711 | | |
| 8712 | | 2158 atoms, 2326 bonds, 68 residues, 1 model selected |
| 8713 | | |
| 8714 | | > hbonds sel saveFile "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 8715 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 8716 | | > structures/PDBs/ylODC_oriA006_complete/hbond_oriA_generation_ver20" dashes 6 |
| 8717 | | > restrict #1/A,B,C,D,E,F,G distSlop 0.5 twoColors true slopColor #00f900 |
| 8718 | | > intraRes false select true reveal true retainCurrent true log true |
| 8719 | | |
| 8720 | | |
| 8721 | | Finding intermodel H-bonds |
| 8722 | | Finding intramodel H-bonds |
| 8723 | | Constraints relaxed by 0.5 angstroms and 20 degrees |
| 8724 | | Models used: |
| 8725 | | 1 ARMori_ODC_ver20_DNAchainfix_PostPhenix.pdb |
| 8726 | | |
| 8727 | | 42 H-bonds |
| 8728 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 8729 | | /A ASN 436 ND2 /main DA -13 OP1 /A ASN 436 HD22 2.810 1.833 |
| 8730 | | /B LYS 148 NZ /opp DA -10 OP1 /B LYS 148 HZ3 3.208 2.369 |
| 8731 | | /B LYS 279 N /opp DA 10 OP1 /B LYS 279 H 3.110 2.192 |
| 8732 | | /C LYS 188 NZ /main DC -8 OP1 /C LYS 188 HZ1 3.176 2.193 |
| 8733 | | /C ARG 219 N /opp DA 12 OP1 /C ARG 219 H 3.467 2.499 |
| 8734 | | /C ARG 219 NH1 /opp DT 11 OP2 /C ARG 219 HH11 3.015 2.053 |
| 8735 | | /C ARG 220 NH1 /main DT -10 O2 /C ARG 220 HH11 3.388 2.481 |
| 8736 | | /C TYR 223 OH /main DC -8 OP1 /C TYR 223 HH 2.762 1.806 |
| 8737 | | /C TYR 607 OH /main DC 6 OP2 /C TYR 607 HH 3.098 2.200 |
| 8738 | | /C LYS 671 N /main DC 6 OP1 /C LYS 671 H 3.429 2.701 |
| 8739 | | /C ARG 672 N /main DC 6 OP1 /C ARG 672 H 3.388 2.439 |
| 8740 | | /C ARG 672 NH1 /opp DT -4 O2 /C ARG 672 HH12 2.806 1.902 |
| 8741 | | /C ARG 672 NH2 /opp DT -4 O2 /C ARG 672 HH22 2.902 2.042 |
| 8742 | | /C ARG 672 NH2 /opp DT -4 O4' /C ARG 672 HH22 3.185 2.472 |
| 8743 | | /C LYS 673 NZ /main DT 7 OP1 /C LYS 673 HZ1 3.030 2.116 |
| 8744 | | /D SER 169 OG /main DA -11 OP1 /D SER 169 HG 3.284 2.325 |
| 8745 | | /D SER 463 OG /opp DT 1 OP2 /D SER 463 HG 2.803 1.844 |
| 8746 | | /D LYS 465 NZ /opp DG 2 N7 /D LYS 465 HZ1 3.514 2.654 |
| 8747 | | /D LYS 465 NZ /opp DG 2 O6 /D LYS 465 HZ1 3.045 2.260 |
| 8748 | | /D LYS 465 NZ /opp DG 3 O6 /D LYS 465 HZ2 3.189 2.368 |
| 8749 | | /E ARG 76 NH1 /main DG -9 OP1 /E ARG 76 HH11 2.908 2.005 |
| 8750 | | /E ARG 340 NH1 /opp DA -10 OP2 /E ARG 340 HH11 3.135 2.272 |
| 8751 | | /E ARG 356 NH1 /opp DT -11 OP2 /E ARG 356 HH11 2.946 2.163 |
| 8752 | | /E ARG 357 N /opp DT -11 OP1 /E ARG 357 H 3.073 2.081 |
| 8753 | | /E ARG 357 NH1 /opp DT -13 O2 /E ARG 357 HH12 2.761 1.945 |
| 8754 | | /E ARG 357 NH2 /opp DT -13 O2 /E ARG 357 HH22 2.690 1.846 |
| 8755 | | /E GLU 358 N /main DG 15 OP1 /E GLU 358 H 3.275 2.276 |
| 8756 | | /E THR 359 OG1 /opp DA -10 OP1 /E THR 359 HG1 2.552 1.830 |
| 8757 | | /E ARG 362 N /opp DA -10 O3' /E ARG 362 H 3.515 2.618 |
| 8758 | | /E ARG 362 N /opp DG -9 OP2 /E ARG 362 H 2.892 2.000 |
| 8759 | | /E ARG 362 NH2 /main DC 12 O2 /E ARG 362 HH22 3.076 2.066 |
| 8760 | | /E LYS 363 N /opp DG -9 OP2 /E LYS 363 H 3.221 2.221 |
| 8761 | | /E LYS 363 NZ /opp DG -8 OP2 /E LYS 363 HZ1 2.890 1.985 |
| 8762 | | /G LYS 547 NZ /opp DG 3 OP1 /G LYS 547 HZ1 3.303 2.294 |
| 8763 | | /G LYS 548 NZ /main DT 1 O2 /G LYS 548 HZ1 2.747 2.031 |
| 8764 | | /G LYS 548 NZ /opp DT 0 O2 /G LYS 548 HZ3 3.045 2.142 |
| 8765 | | /G ASN 553 N /opp DG 3 OP2 /G ASN 553 H 3.220 2.217 |
| 8766 | | /G ARG 557 NH1 /opp DG 6 N7 /G ARG 557 HH12 3.403 2.708 |
| 8767 | | /G ARG 557 NH2 /opp DG 6 N7 /G ARG 557 HH22 3.082 2.292 |
| 8768 | | /G GLY 561 N /main DT -10 OP1 /G GLY 561 H 2.977 2.057 |
| 8769 | | /G THR 563 N /main DT -10 OP2 /G THR 563 H 3.051 2.249 |
| 8770 | | /G ALA 565 N /main DG -9 OP2 /G ALA 565 H 3.032 2.059 |
| 8771 | | |
| 8772 | | |
| 8773 | | |
| 8774 | | 42 hydrogen bonds found |
| 8775 | | 8 strict hydrogen bonds found |
| 8776 | | |
| 8777 | | > select up |
| 8778 | | |
| 8779 | | 1335 atoms, 1364 bonds, 53 residues, 1 model selected |
| 8780 | | |
| 8781 | | > show sel atoms |
| 8782 | | |
| 8783 | | > select clear |
| 8784 | | |
| 8785 | | > select /A:436-436 |
| 8786 | | |
| 8787 | | 14 atoms, 13 bonds, 1 residue, 1 model selected |
| 8788 | | |
| 8789 | | > show sel atoms |
| 8790 | | |
| 8791 | | > select /A:435-436 |
| 8792 | | |
| 8793 | | 28 atoms, 27 bonds, 2 residues, 1 model selected |
| 8794 | | |
| 8795 | | > show sel atoms |
| 8796 | | |
| 8797 | | > select nucleic |
| 8798 | | |
| 8799 | | 2158 atoms, 2326 bonds, 68 residues, 1 model selected |
| 8800 | | |
| 8801 | | > select clear |
| 8802 | | |
| 8803 | | > show cartoons |
| 8804 | | |
| 8805 | | > select nucleic |
| 8806 | | |
| 8807 | | 2158 atoms, 2326 bonds, 68 residues, 1 model selected |
| 8808 | | |
| 8809 | | > hbonds sel saveFile "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 8810 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 8811 | | > structures/PDBs/ylODC_oriA006_complete/hbond_oriA_generation_ver20_relaxed40" |
| 8812 | | > dashes 6 restrict #1/A,B,C,D,E,F,G distSlop 0.5 angleSlop 40.0 twoColors |
| 8813 | | > true slopColor #ff9300 intraRes false select true reveal true retainCurrent |
| 8814 | | > true log true |
| 8815 | | |
| 8816 | | |
| 8817 | | Finding intermodel H-bonds |
| 8818 | | Finding intramodel H-bonds |
| 8819 | | Constraints relaxed by 0.5 angstroms and 40 degrees |
| 8820 | | Models used: |
| 8821 | | 1 ARMori_ODC_ver20_DNAchainfix_PostPhenix.pdb |
| 8822 | | |
| 8823 | | 53 H-bonds |
| 8824 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 8825 | | /A GLN 306 NE2 /opp DG 15 O3' /A GLN 306 HE22 3.342 2.769 |
| 8826 | | /A ASN 436 ND2 /main DA -13 OP1 /A ASN 436 HD22 2.810 1.833 |
| 8827 | | /B LYS 148 NZ /opp DA -10 OP1 /B LYS 148 HZ3 3.208 2.369 |
| 8828 | | /B LYS 279 N /opp DA 10 OP1 /B LYS 279 H 3.110 2.192 |
| 8829 | | /C LYS 188 NZ /main DC -8 OP1 /C LYS 188 HZ1 3.176 2.193 |
| 8830 | | /C ARG 219 N /opp DA 12 OP1 /C ARG 219 H 3.467 2.499 |
| 8831 | | /C ARG 219 NH1 /opp DT 11 OP2 /C ARG 219 HH11 3.015 2.053 |
| 8832 | | /C ARG 220 NH1 /main DT -10 O2 /C ARG 220 HH11 3.388 2.481 |
| 8833 | | /C ARG 220 NH1 /opp DT 11 O2 /C ARG 220 HH11 3.296 2.935 |
| 8834 | | /C TYR 223 OH /main DG -9 O3' /C TYR 223 HH 3.522 2.887 |
| 8835 | | /C TYR 223 OH /main DC -8 OP1 /C TYR 223 HH 2.762 1.806 |
| 8836 | | /C TYR 607 OH /main DC 6 OP2 /C TYR 607 HH 3.098 2.200 |
| 8837 | | /C LYS 671 N /main DC 6 OP1 /C LYS 671 H 3.429 2.701 |
| 8838 | | /C ARG 672 N /main DC 6 OP1 /C ARG 672 H 3.388 2.439 |
| 8839 | | /C ARG 672 NH1 /opp DT -4 O2 /C ARG 672 HH12 2.806 1.902 |
| 8840 | | /C ARG 672 NH2 /opp DT -4 O2 /C ARG 672 HH22 2.902 2.042 |
| 8841 | | /C ARG 672 NH2 /opp DT -4 O4' /C ARG 672 HH22 3.185 2.472 |
| 8842 | | /C LYS 673 NZ /main DT 7 OP1 /C LYS 673 HZ1 3.030 2.116 |
| 8843 | | /D LYS 168 NZ /main DT -12 O2 /D LYS 168 HZ1 2.564 2.050 |
| 8844 | | /D SER 169 OG /main DA -11 OP1 /D SER 169 HG 3.284 2.325 |
| 8845 | | /D SER 463 OG /opp DT 1 OP2 /D SER 463 HG 2.803 1.844 |
| 8846 | | /D LYS 465 NZ /opp DG 2 N7 /D LYS 465 HZ1 3.514 2.654 |
| 8847 | | /D LYS 465 NZ /opp DG 2 O6 /D LYS 465 HZ1 3.045 2.260 |
| 8848 | | /D LYS 465 NZ /opp DG 3 O6 /D LYS 465 HZ2 3.189 2.368 |
| 8849 | | /E ARG 76 NH1 /main DG -9 OP1 /E ARG 76 HH11 2.908 2.005 |
| 8850 | | /E ARG 340 NH1 /opp DA -10 OP2 /E ARG 340 HH11 3.135 2.272 |
| 8851 | | /E ARG 356 NH1 /opp DT -11 OP2 /E ARG 356 HH11 2.946 2.163 |
| 8852 | | /E ARG 357 N /opp DT -11 OP1 /E ARG 357 H 3.073 2.081 |
| 8853 | | /E ARG 357 NH1 /opp DT -13 O2 /E ARG 357 HH12 2.761 1.945 |
| 8854 | | /E ARG 357 NH2 /opp DT -13 O2 /E ARG 357 HH22 2.690 1.846 |
| 8855 | | /E GLU 358 N /main DG 15 OP1 /E GLU 358 H 3.275 2.276 |
| 8856 | | /E THR 359 OG1 /opp DA -10 OP1 /E THR 359 HG1 2.552 1.830 |
| 8857 | | /E ARG 362 N /opp DA -10 O3' /E ARG 362 H 3.515 2.618 |
| 8858 | | /E ARG 362 N /opp DG -9 OP2 /E ARG 362 H 2.892 2.000 |
| 8859 | | /E ARG 362 NH1 /main DC 12 O4' /E ARG 362 HH12 3.369 2.780 |
| 8860 | | /E ARG 362 NH2 /main DC 12 O2 /E ARG 362 HH22 3.076 2.066 |
| 8861 | | /E ARG 362 NH2 /main DA 13 O4' /E ARG 362 HH21 3.065 2.496 |
| 8862 | | /E LYS 363 N /opp DG -9 OP2 /E LYS 363 H 3.221 2.221 |
| 8863 | | /E LYS 363 NZ /opp DG -8 OP1 /E LYS 363 HZ3 2.954 2.284 |
| 8864 | | /E LYS 363 NZ /opp DG -8 OP2 /E LYS 363 HZ1 2.890 1.985 |
| 8865 | | /G GLY 546 N /main DT 1 OP1 /G GLY 546 H 3.276 2.580 |
| 8866 | | /G LYS 547 NZ /opp DG 3 OP1 /G LYS 547 HZ1 3.303 2.294 |
| 8867 | | /G LYS 548 NZ /main DT 1 O2 /G LYS 548 HZ1 2.747 2.031 |
| 8868 | | /G LYS 548 NZ /main DC 2 O4' /G LYS 548 HZ2 2.889 2.196 |
| 8869 | | /G LYS 548 NZ /opp DT 0 O2 /G LYS 548 HZ3 3.045 2.142 |
| 8870 | | /G ASN 553 N /opp DG 3 OP2 /G ASN 553 H 3.220 2.217 |
| 8871 | | /G ARG 557 NH1 /opp DG 6 N7 /G ARG 557 HH12 3.403 2.708 |
| 8872 | | /G ARG 557 NH1 /opp DG 6 O6 /G ARG 557 HH12 2.566 1.988 |
| 8873 | | /G ARG 557 NH2 /opp DG 6 N7 /G ARG 557 HH22 3.082 2.292 |
| 8874 | | /G LYS 560 NZ /main DA -11 OP2 /G LYS 560 HZ1 2.981 2.268 |
| 8875 | | /G GLY 561 N /main DT -10 OP1 /G GLY 561 H 2.977 2.057 |
| 8876 | | /G THR 563 N /main DT -10 OP2 /G THR 563 H 3.051 2.249 |
| 8877 | | /G ALA 565 N /main DG -9 OP2 /G ALA 565 H 3.032 2.059 |
| 8878 | | |
| 8879 | | |
| 8880 | | |
| 8881 | | 53 hydrogen bonds found |
| 8882 | | 8 strict hydrogen bonds found |
| 8883 | | |
| 8884 | | > select clear |
| 8885 | | |
| 8886 | | > select ~nucleic |
| 8887 | | |
| 8888 | | 47052 atoms, 47494 bonds, 16 pseudobonds, 2932 residues, 3 models selected |
| 8889 | | |
| 8890 | | > hide sel cartoons |
| 8891 | | |
| 8892 | | > select clear |
| 8893 | | |
| 8894 | | > select /main:-13 |
| 8895 | | |
| 8896 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 8897 | | |
| 8898 | | > hide sel atoms |
| 8899 | | |
| 8900 | | > show sel atoms |
| 8901 | | |
| 8902 | | > hide sel cartoons |
| 8903 | | |
| 8904 | | > select /A:301,306,303,435,436,305 |
| 8905 | | |
| 8906 | | 111 atoms, 108 bonds, 6 residues, 1 model selected |
| 8907 | | |
| 8908 | | > show sel atoms |
| 8909 | | |
| 8910 | | > select /B:279,280,248,153,150,148 |
| 8911 | | |
| 8912 | | 109 atoms, 104 bonds, 6 residues, 1 model selected |
| 8913 | | |
| 8914 | | > show sel atoms |
| 8915 | | |
| 8916 | | > select /C:219,220,223,188,671-673 |
| 8917 | | |
| 8918 | | 159 atoms, 156 bonds, 7 residues, 1 model selected |
| 8919 | | |
| 8920 | | > show sel atoms |
| 8921 | | |
| 8922 | | > select clear |
| 8923 | | |
| 8924 | | > select /D:168,169,465,463 |
| 8925 | | |
| 8926 | | 66 atoms, 63 bonds, 4 residues, 1 model selected |
| 8927 | | |
| 8928 | | > show sel atoms |
| 8929 | | |
| 8930 | | > select clear |
| 8931 | | |
| 8932 | | > select /E:76,341,363,359,362,340,356,357,358 |
| 8933 | | |
| 8934 | | 192 atoms, 189 bonds, 9 residues, 1 model selected |
| 8935 | | |
| 8936 | | > show sel atoms |
| 8937 | | |
| 8938 | | > select clear |
| 8939 | | |
| 8940 | | > select /G:560,561,563,565,557,547,548,543,581,546 |
| 8941 | | |
| 8942 | | 157 atoms, 150 bonds, 10 residues, 1 model selected |
| 8943 | | |
| 8944 | | > show sel atoms |
| 8945 | | |
| 8946 | | > select clear |
| 8947 | | |
| 8948 | | > select /main:-1 |
| 8949 | | |
| 8950 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 8951 | | |
| 8952 | | > hide sel cartoons |
| 8953 | | |
| 8954 | | > show sel cartoons |
| 8955 | | |
| 8956 | | > select /main:0 |
| 8957 | | |
| 8958 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 8959 | | |
| 8960 | | > hide sel cartoons |
| 8961 | | |
| 8962 | | > select /main:-1 |
| 8963 | | |
| 8964 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 8965 | | |
| 8966 | | > hide sel cartoons |
| 8967 | | |
| 8968 | | > select clear |
| 8969 | | |
| 8970 | | Drag select of 2 atoms, 2 bonds |
| 8971 | | |
| 8972 | | > select clear |
| 8973 | | |
| 8974 | | > select /A:305@NZ |
| 8975 | | |
| 8976 | | 1 atom, 1 residue, 1 model selected |
| 8977 | | |
| 8978 | | > select /main:-12 |
| 8979 | | |
| 8980 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 8981 | | |
| 8982 | | > hide sel cartoons |
| 8983 | | |
| 8984 | | > select /main:-13@C3' |
| 8985 | | |
| 8986 | | 1 atom, 1 residue, 1 model selected |
| 8987 | | |
| 8988 | | > show sel cartoons |
| 8989 | | |
| 8990 | | > select clear |
| 8991 | | |
| 8992 | | > select /main:-11 |
| 8993 | | |
| 8994 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 8995 | | |
| 8996 | | > select nucleic |
| 8997 | | |
| 8998 | | 2158 atoms, 2326 bonds, 68 residues, 1 model selected |
| 8999 | | |
| 9000 | | > hbonds sel saveFile "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 9001 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 9002 | | > structures/PDBs/ylODC_oriA006_complete/hbond_oriA_generation_ver20" dashes 6 |
| 9003 | | > restrict #1/A,B,C,D,E,F,G distSlop 0.5 twoColors true slopColor #00f900 |
| 9004 | | > intraRes false select true reveal true retainCurrent true log true |
| 9005 | | |
| 9006 | | |
| 9007 | | Finding intermodel H-bonds |
| 9008 | | Finding intramodel H-bonds |
| 9009 | | Constraints relaxed by 0.5 angstroms and 20 degrees |
| 9010 | | Models used: |
| 9011 | | 1 ARMori_ODC_ver20_DNAchainfix_PostPhenix.pdb |
| 9012 | | |
| 9013 | | 42 H-bonds |
| 9014 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 9015 | | /A ASN 436 ND2 /main DA -13 OP1 /A ASN 436 HD22 2.810 1.833 |
| 9016 | | /B LYS 148 NZ /opp DA -10 OP1 /B LYS 148 HZ3 3.208 2.369 |
| 9017 | | /B LYS 279 N /opp DA 10 OP1 /B LYS 279 H 3.110 2.192 |
| 9018 | | /C LYS 188 NZ /main DC -8 OP1 /C LYS 188 HZ1 3.176 2.193 |
| 9019 | | /C ARG 219 N /opp DA 12 OP1 /C ARG 219 H 3.467 2.499 |
| 9020 | | /C ARG 219 NH1 /opp DT 11 OP2 /C ARG 219 HH11 3.015 2.053 |
| 9021 | | /C ARG 220 NH1 /main DT -10 O2 /C ARG 220 HH11 3.388 2.481 |
| 9022 | | /C TYR 223 OH /main DC -8 OP1 /C TYR 223 HH 2.762 1.806 |
| 9023 | | /C TYR 607 OH /main DC 6 OP2 /C TYR 607 HH 3.098 2.200 |
| 9024 | | /C LYS 671 N /main DC 6 OP1 /C LYS 671 H 3.429 2.701 |
| 9025 | | /C ARG 672 N /main DC 6 OP1 /C ARG 672 H 3.388 2.439 |
| 9026 | | /C ARG 672 NH1 /opp DT -4 O2 /C ARG 672 HH12 2.806 1.902 |
| 9027 | | /C ARG 672 NH2 /opp DT -4 O2 /C ARG 672 HH22 2.902 2.042 |
| 9028 | | /C ARG 672 NH2 /opp DT -4 O4' /C ARG 672 HH22 3.185 2.472 |
| 9029 | | /C LYS 673 NZ /main DT 7 OP1 /C LYS 673 HZ1 3.030 2.116 |
| 9030 | | /D SER 169 OG /main DA -11 OP1 /D SER 169 HG 3.284 2.325 |
| 9031 | | /D SER 463 OG /opp DT 1 OP2 /D SER 463 HG 2.803 1.844 |
| 9032 | | /D LYS 465 NZ /opp DG 2 N7 /D LYS 465 HZ1 3.514 2.654 |
| 9033 | | /D LYS 465 NZ /opp DG 2 O6 /D LYS 465 HZ1 3.045 2.260 |
| 9034 | | /D LYS 465 NZ /opp DG 3 O6 /D LYS 465 HZ2 3.189 2.368 |
| 9035 | | /E ARG 76 NH1 /main DG -9 OP1 /E ARG 76 HH11 2.908 2.005 |
| 9036 | | /E ARG 340 NH1 /opp DA -10 OP2 /E ARG 340 HH11 3.135 2.272 |
| 9037 | | /E ARG 356 NH1 /opp DT -11 OP2 /E ARG 356 HH11 2.946 2.163 |
| 9038 | | /E ARG 357 N /opp DT -11 OP1 /E ARG 357 H 3.073 2.081 |
| 9039 | | /E ARG 357 NH1 /opp DT -13 O2 /E ARG 357 HH12 2.761 1.945 |
| 9040 | | /E ARG 357 NH2 /opp DT -13 O2 /E ARG 357 HH22 2.690 1.846 |
| 9041 | | /E GLU 358 N /main DG 15 OP1 /E GLU 358 H 3.275 2.276 |
| 9042 | | /E THR 359 OG1 /opp DA -10 OP1 /E THR 359 HG1 2.552 1.830 |
| 9043 | | /E ARG 362 N /opp DA -10 O3' /E ARG 362 H 3.515 2.618 |
| 9044 | | /E ARG 362 N /opp DG -9 OP2 /E ARG 362 H 2.892 2.000 |
| 9045 | | /E ARG 362 NH2 /main DC 12 O2 /E ARG 362 HH22 3.076 2.066 |
| 9046 | | /E LYS 363 N /opp DG -9 OP2 /E LYS 363 H 3.221 2.221 |
| 9047 | | /E LYS 363 NZ /opp DG -8 OP2 /E LYS 363 HZ1 2.890 1.985 |
| 9048 | | /G LYS 547 NZ /opp DG 3 OP1 /G LYS 547 HZ1 3.303 2.294 |
| 9049 | | /G LYS 548 NZ /main DT 1 O2 /G LYS 548 HZ1 2.747 2.031 |
| 9050 | | /G LYS 548 NZ /opp DT 0 O2 /G LYS 548 HZ3 3.045 2.142 |
| 9051 | | /G ASN 553 N /opp DG 3 OP2 /G ASN 553 H 3.220 2.217 |
| 9052 | | /G ARG 557 NH1 /opp DG 6 N7 /G ARG 557 HH12 3.403 2.708 |
| 9053 | | /G ARG 557 NH2 /opp DG 6 N7 /G ARG 557 HH22 3.082 2.292 |
| 9054 | | /G GLY 561 N /main DT -10 OP1 /G GLY 561 H 2.977 2.057 |
| 9055 | | /G THR 563 N /main DT -10 OP2 /G THR 563 H 3.051 2.249 |
| 9056 | | /G ALA 565 N /main DG -9 OP2 /G ALA 565 H 3.032 2.059 |
| 9057 | | |
| 9058 | | |
| 9059 | | |
| 9060 | | 42 hydrogen bonds found |
| 9061 | | 8 strict hydrogen bonds found |
| 9062 | | |
| 9063 | | > select clear |
| 9064 | | |
| 9065 | | > select /main:-9 |
| 9066 | | |
| 9067 | | 33 atoms, 35 bonds, 1 residue, 1 model selected |
| 9068 | | |
| 9069 | | > select /main:-8 |
| 9070 | | |
| 9071 | | 30 atoms, 31 bonds, 1 residue, 1 model selected |
| 9072 | | |
| 9073 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 9074 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 9075 | | > structures/PDBs/ylODC_oriA006_complete/ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb" |
| 9076 | | |
| 9077 | | Chain information for ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2 |
| 9078 | | --- |
| 9079 | | Chain | Description |
| 9080 | | A | No description available |
| 9081 | | B | No description available |
| 9082 | | C | No description available |
| 9083 | | D | No description available |
| 9084 | | E | No description available |
| 9085 | | F | No description available |
| 9086 | | G | No description available |
| 9087 | | H | No description available |
| 9088 | | I | No description available |
| 9089 | | |
| 9090 | | |
| 9091 | | > select #2 |
| 9092 | | |
| 9093 | | 24882 atoms, 25492 bonds, 16 pseudobonds, 3000 residues, 3 models selected |
| 9094 | | |
| 9095 | | > show sel atoms |
| 9096 | | |
| 9097 | | > show sel cartoons |
| 9098 | | |
| 9099 | | > style sel stick |
| 9100 | | |
| 9101 | | Changed 24882 atom styles |
| 9102 | | |
| 9103 | | > newcolor #2/A #2/B #2/C #2/D #2/E #2/F #2/G #2/H #2/I |
| 9104 | | |
| 9105 | | > color sel byhetero |
| 9106 | | |
| 9107 | | > hide sel atoms |
| 9108 | | |
| 9109 | | > select clear |
| 9110 | | |
| 9111 | | > select #2 & nucleic |
| 9112 | | |
| 9113 | | 1391 atoms, 1559 bonds, 68 residues, 1 model selected |
| 9114 | | |
| 9115 | | > hbonds sel dashes 6 restrict #2/A,B,C,D,E,F,G distSlop 0.5 twoColors true |
| 9116 | | > slopColor #00f900 intraRes false select true reveal true retainCurrent true |
| 9117 | | > log true |
| 9118 | | |
| 9119 | | |
| 9120 | | Finding intermodel H-bonds |
| 9121 | | Finding intramodel H-bonds |
| 9122 | | Constraints relaxed by 0.5 angstroms and 20 degrees |
| 9123 | | Models used: |
| 9124 | | 2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb |
| 9125 | | |
| 9126 | | 46 H-bonds |
| 9127 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 9128 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/A ASN 436 ND2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DA 10 OP1 no hydrogen 2.810 N/A |
| 9129 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/B LYS 148 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DA 28 OP1 no hydrogen 3.208 N/A |
| 9130 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/B LYS 279 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DA 48 OP1 no hydrogen 3.110 N/A |
| 9131 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C LYS 188 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DC 15 OP1 no hydrogen 3.176 N/A |
| 9132 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 219 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DA 50 OP1 no hydrogen 3.467 N/A |
| 9133 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 219 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 49 OP2 no hydrogen 3.015 N/A |
| 9134 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 220 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DT 13 O2 no hydrogen 3.388 N/A |
| 9135 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C TYR 223 OH ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DC 15 OP1 no hydrogen 2.762 N/A |
| 9136 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C TYR 607 OH ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DC 29 OP2 no hydrogen 3.098 N/A |
| 9137 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 672 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DC 29 OP1 no hydrogen 3.388 N/A |
| 9138 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 672 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 34 O2 no hydrogen 2.806 N/A |
| 9139 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 672 NH2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 34 O2 no hydrogen 2.902 N/A |
| 9140 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 672 NH2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 34 O4' no hydrogen 3.185 N/A |
| 9141 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C LYS 673 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DT 30 OP1 no hydrogen 3.030 N/A |
| 9142 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D LYS 168 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DT 11 O2 no hydrogen 2.564 N/A |
| 9143 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D SER 169 OG ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DA 12 OP1 no hydrogen 3.284 N/A |
| 9144 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D SER 463 OG ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 39 OP2 no hydrogen 2.803 N/A |
| 9145 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D LYS 465 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 40 N7 no hydrogen 3.514 N/A |
| 9146 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D LYS 465 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 40 O6 no hydrogen 3.045 N/A |
| 9147 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D LYS 465 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 41 O6 no hydrogen 3.189 N/A |
| 9148 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 76 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DG 14 OP1 no hydrogen 2.908 N/A |
| 9149 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 340 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DA 28 OP2 no hydrogen 3.135 N/A |
| 9150 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 356 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 27 OP2 no hydrogen 2.946 N/A |
| 9151 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 357 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 27 OP1 no hydrogen 3.073 N/A |
| 9152 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 357 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 25 O2 no hydrogen 2.761 N/A |
| 9153 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 357 NH2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 25 O2 no hydrogen 2.690 N/A |
| 9154 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E GLU 358 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DG 38 OP1 no hydrogen 3.275 N/A |
| 9155 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E THR 359 OG1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DA 28 OP1 no hydrogen 2.552 N/A |
| 9156 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 362 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DA 28 O3' no hydrogen 3.515 N/A |
| 9157 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 362 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 29 OP2 no hydrogen 2.892 N/A |
| 9158 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 362 NH2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DC 35 O2 no hydrogen 3.076 N/A |
| 9159 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E LYS 363 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 29 OP2 no hydrogen 3.221 N/A |
| 9160 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E LYS 363 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 30 OP2 no hydrogen 2.890 N/A |
| 9161 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G THR 542 OG1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DA 23 OP1 no hydrogen 3.290 N/A |
| 9162 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G GLY 546 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DT 24 OP1 no hydrogen 3.276 N/A |
| 9163 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LYS 547 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 41 OP1 no hydrogen 3.303 N/A |
| 9164 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LYS 548 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DT 24 O2 no hydrogen 2.747 N/A |
| 9165 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LYS 548 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DC 25 O4' no hydrogen 2.889 N/A |
| 9166 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LYS 548 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 38 O2 no hydrogen 3.045 N/A |
| 9167 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ASN 553 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 41 OP2 no hydrogen 3.220 N/A |
| 9168 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ARG 557 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 44 N7 no hydrogen 3.403 N/A |
| 9169 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ARG 557 NH2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 44 N7 no hydrogen 3.082 N/A |
| 9170 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LYS 560 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DA 12 OP2 no hydrogen 2.981 N/A |
| 9171 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G GLY 561 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DT 13 OP1 no hydrogen 2.977 N/A |
| 9172 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G THR 563 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DT 13 OP2 no hydrogen 3.051 N/A |
| 9173 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ALA 565 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DG 14 OP2 no hydrogen 3.032 N/A |
| 9174 | | |
| 9175 | | |
| 9176 | | |
| 9177 | | 46 hydrogen bonds found |
| 9178 | | 13 strict hydrogen bonds found |
| 9179 | | |
| 9180 | | > select up |
| 9181 | | |
| 9182 | | 840 atoms, 876 bonds, 59 residues, 1 model selected |
| 9183 | | |
| 9184 | | > show sel atoms |
| 9185 | | |
| 9186 | | > select #2 & ~nucleic |
| 9187 | | |
| 9188 | | 23491 atoms, 23933 bonds, 16 pseudobonds, 2932 residues, 3 models selected |
| 9189 | | |
| 9190 | | > hide sel cartoons |
| 9191 | | |
| 9192 | | > select clear |
| 9193 | | |
| 9194 | | > hide #!1 models |
| 9195 | | |
| 9196 | | > show #!1 models |
| 9197 | | |
| 9198 | | > hide #!1 models |
| 9199 | | |
| 9200 | | > show #!1 models |
| 9201 | | |
| 9202 | | > hide #!1 models |
| 9203 | | |
| 9204 | | > show #!1 models |
| 9205 | | |
| 9206 | | > select #2 & nucleic |
| 9207 | | |
| 9208 | | 1391 atoms, 1559 bonds, 68 residues, 1 model selected |
| 9209 | | |
| 9210 | | > hbonds sel dashes 6 restrict #2/A,B,C,D,E,F,G distSlop 0.5 angleSlop 40.0 |
| 9211 | | > twoColors true slopColor #ff9300 intraRes false select true reveal true |
| 9212 | | > retainCurrent true log true |
| 9213 | | |
| 9214 | | |
| 9215 | | Finding intermodel H-bonds |
| 9216 | | Finding intramodel H-bonds |
| 9217 | | Constraints relaxed by 0.5 angstroms and 40 degrees |
| 9218 | | Models used: |
| 9219 | | 2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb |
| 9220 | | |
| 9221 | | 55 H-bonds |
| 9222 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 9223 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/A ARG 301 NH2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 54 N3 no hydrogen 3.290 N/A |
| 9224 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/A GLN 306 NE2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 53 O3' no hydrogen 3.342 N/A |
| 9225 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/A ASN 436 ND2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DA 10 OP1 no hydrogen 2.810 N/A |
| 9226 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/B LYS 148 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DA 28 OP1 no hydrogen 3.208 N/A |
| 9227 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/B LYS 279 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DA 48 OP1 no hydrogen 3.110 N/A |
| 9228 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C LYS 188 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DC 15 OP1 no hydrogen 3.176 N/A |
| 9229 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 219 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DA 50 OP1 no hydrogen 3.467 N/A |
| 9230 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 219 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 49 OP2 no hydrogen 3.015 N/A |
| 9231 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 220 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DT 13 O2 no hydrogen 3.388 N/A |
| 9232 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 220 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 49 O2 no hydrogen 3.296 N/A |
| 9233 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C TYR 223 OH ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DG 14 O3' no hydrogen 3.522 N/A |
| 9234 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C TYR 223 OH ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DC 15 OP1 no hydrogen 2.762 N/A |
| 9235 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C TYR 607 OH ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DC 29 OP2 no hydrogen 3.098 N/A |
| 9236 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 672 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DC 29 OP1 no hydrogen 3.388 N/A |
| 9237 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 672 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 34 O2 no hydrogen 2.806 N/A |
| 9238 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 672 NH2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 34 O2 no hydrogen 2.902 N/A |
| 9239 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 672 NH2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 34 O4' no hydrogen 3.185 N/A |
| 9240 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C LYS 673 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DT 30 OP1 no hydrogen 3.030 N/A |
| 9241 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D LYS 168 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DT 11 O2 no hydrogen 2.564 N/A |
| 9242 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D SER 169 OG ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DA 12 OP1 no hydrogen 3.284 N/A |
| 9243 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D SER 463 OG ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 39 OP2 no hydrogen 2.803 N/A |
| 9244 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D LYS 465 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 40 N7 no hydrogen 3.514 N/A |
| 9245 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D LYS 465 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 40 O6 no hydrogen 3.045 N/A |
| 9246 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D LYS 465 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 41 O6 no hydrogen 3.189 N/A |
| 9247 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 76 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DG 14 OP1 no hydrogen 2.908 N/A |
| 9248 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 340 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DA 28 OP2 no hydrogen 3.135 N/A |
| 9249 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 356 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 27 OP2 no hydrogen 2.946 N/A |
| 9250 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 357 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 27 OP1 no hydrogen 3.073 N/A |
| 9251 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 357 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 25 O2 no hydrogen 2.761 N/A |
| 9252 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 357 NH2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 25 O2 no hydrogen 2.690 N/A |
| 9253 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E GLU 358 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DG 38 OP1 no hydrogen 3.275 N/A |
| 9254 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E THR 359 OG1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DA 28 OP1 no hydrogen 2.552 N/A |
| 9255 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 362 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DA 28 O3' no hydrogen 3.515 N/A |
| 9256 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 362 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 29 OP2 no hydrogen 2.892 N/A |
| 9257 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 362 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DC 35 O4' no hydrogen 3.369 N/A |
| 9258 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 362 NH2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DC 35 O2 no hydrogen 3.076 N/A |
| 9259 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 362 NH2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DA 36 O4' no hydrogen 3.065 N/A |
| 9260 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E LYS 363 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 29 OP2 no hydrogen 3.221 N/A |
| 9261 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E LYS 363 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 30 OP1 no hydrogen 2.954 N/A |
| 9262 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E LYS 363 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 30 OP2 no hydrogen 2.890 N/A |
| 9263 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G THR 542 OG1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DA 23 OP1 no hydrogen 3.290 N/A |
| 9264 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G GLY 546 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DT 24 OP1 no hydrogen 3.276 N/A |
| 9265 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LYS 547 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 41 OP1 no hydrogen 3.303 N/A |
| 9266 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LYS 548 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DT 24 O2 no hydrogen 2.747 N/A |
| 9267 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LYS 548 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DC 25 O4' no hydrogen 2.889 N/A |
| 9268 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LYS 548 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 38 O2 no hydrogen 3.045 N/A |
| 9269 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ASN 553 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 41 OP2 no hydrogen 3.220 N/A |
| 9270 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ARG 557 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 44 N7 no hydrogen 3.403 N/A |
| 9271 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ARG 557 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 44 O6 no hydrogen 2.566 N/A |
| 9272 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ARG 557 NH2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 44 N7 no hydrogen 3.082 N/A |
| 9273 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LYS 560 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DA 12 OP2 no hydrogen 2.981 N/A |
| 9274 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G GLY 561 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DT 13 OP1 no hydrogen 2.977 N/A |
| 9275 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G THR 563 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DT 13 OP2 no hydrogen 3.051 N/A |
| 9276 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G GLY 564 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DT 13 OP2 no hydrogen 2.948 N/A |
| 9277 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ALA 565 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DG 14 OP2 no hydrogen 3.032 N/A |
| 9278 | | |
| 9279 | | |
| 9280 | | |
| 9281 | | 55 hydrogen bonds found |
| 9282 | | 13 strict hydrogen bonds found |
| 9283 | | |
| 9284 | | > select up |
| 9285 | | |
| 9286 | | 929 atoms, 972 bonds, 65 residues, 1 model selected |
| 9287 | | |
| 9288 | | > show sel atoms |
| 9289 | | |
| 9290 | | > select clear |
| 9291 | | |
| 9292 | | > ui tool show "Add Hydrogens" |
| 9293 | | |
| 9294 | | > addh #!2 |
| 9295 | | |
| 9296 | | Summary of feedback from adding hydrogens to |
| 9297 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2 |
| 9298 | | --- |
| 9299 | | warning | Not adding hydrogens to ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DA 22 P because it is missing heavy-atom bond partners |
| 9300 | | notes | No usable SEQRES records for ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb (#2) chain A; guessing termini instead |
| 9301 | | No usable SEQRES records for ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb (#2) |
| 9302 | | chain B; guessing termini instead |
| 9303 | | No usable SEQRES records for ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb (#2) |
| 9304 | | chain C; guessing termini instead |
| 9305 | | No usable SEQRES records for ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb (#2) |
| 9306 | | chain D; guessing termini instead |
| 9307 | | No usable SEQRES records for ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb (#2) |
| 9308 | | chain E; guessing termini instead |
| 9309 | | 4 messages similar to the above omitted |
| 9310 | | Chain-initial residues that are actual N termini: |
| 9311 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/A PRO 299, |
| 9312 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/B PRO 106, |
| 9313 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C THR 6, |
| 9314 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D PRO 33, |
| 9315 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E MET 1, |
| 9316 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/F PRO 179, |
| 9317 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G PRO 93 |
| 9318 | | Chain-initial residues that are not actual N termini: |
| 9319 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/B VAL 396, |
| 9320 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/B VAL 444, |
| 9321 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/B LYS 489, |
| 9322 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ASN 72, |
| 9323 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D ASN 128, |
| 9324 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D GLY 162, |
| 9325 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D LEU 296, |
| 9326 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D PHE 436, |
| 9327 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E GLU 217, |
| 9328 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ASP 319, |
| 9329 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/F SER 313, |
| 9330 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ALA 213, |
| 9331 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G THR 386, |
| 9332 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G VAL 439, |
| 9333 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ASN 461 |
| 9334 | | Chain-final residues that are actual C termini: |
| 9335 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/A LEU 718, |
| 9336 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C LEU 685 |
| 9337 | | Chain-final residues that are not actual C termini: |
| 9338 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/B GLU 504, |
| 9339 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/B GLU 386, |
| 9340 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/B HIS 420, |
| 9341 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/B VAL 479, |
| 9342 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 29, |
| 9343 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D ARG 510, |
| 9344 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D SER 123, |
| 9345 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D LEU 159, |
| 9346 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D MET 285, |
| 9347 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D LEU 420, |
| 9348 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ASN 464, |
| 9349 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ALA 210, |
| 9350 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E LEU 304, |
| 9351 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/F GLN 351, |
| 9352 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/F THR 307, |
| 9353 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LEU 604, |
| 9354 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G GLY 207, |
| 9355 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G HIS 335, |
| 9356 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G GLN 433, |
| 9357 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G PHE 457 |
| 9358 | | 2714 hydrogen bonds |
| 9359 | | Adding 'H' to ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/B VAL 396 |
| 9360 | | Adding 'H' to ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/B VAL 444 |
| 9361 | | Adding 'H' to ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/B LYS 489 |
| 9362 | | Adding 'H' to ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ASN 72 |
| 9363 | | Adding 'H' to ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D ASN 128 |
| 9364 | | 10 messages similar to the above omitted |
| 9365 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/B GLU 504 is not terminus, |
| 9366 | | removing H atom from 'C' |
| 9367 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D ARG 510 is not terminus, |
| 9368 | | removing H atom from 'C' |
| 9369 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ASN 464 is not terminus, |
| 9370 | | removing H atom from 'C' |
| 9371 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/F GLN 351 is not terminus, |
| 9372 | | removing H atom from 'C' |
| 9373 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LEU 604 is not terminus, |
| 9374 | | removing H atom from 'C' |
| 9375 | | 24328 hydrogens added |
| 9376 | | |
| 9377 | | |
| 9378 | | > select #2 & nucleic |
| 9379 | | |
| 9380 | | 2158 atoms, 2326 bonds, 68 residues, 1 model selected |
| 9381 | | |
| 9382 | | > hbonds sel dashes 6 restrict #2/A,B,C,D,E,F,G distSlop 0.5 angleSlop 40.0 |
| 9383 | | > twoColors true slopColor #ff9300 intraRes false select true reveal true |
| 9384 | | > retainCurrent true log true |
| 9385 | | |
| 9386 | | |
| 9387 | | Finding intermodel H-bonds |
| 9388 | | Finding intramodel H-bonds |
| 9389 | | Constraints relaxed by 0.5 angstroms and 40 degrees |
| 9390 | | Models used: |
| 9391 | | 2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb |
| 9392 | | |
| 9393 | | 54 H-bonds |
| 9394 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 9395 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/A ARG 301 NH2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 54 N3 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/A ARG 301 HH22 3.290 2.710 |
| 9396 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/A GLN 306 NE2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 53 O3' ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/A GLN 306 HE22 3.342 2.769 |
| 9397 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/A ASN 436 ND2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DA 10 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/A ASN 436 HD22 2.810 1.833 |
| 9398 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/B LYS 148 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DA 28 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/B LYS 148 HZ3 3.208 2.369 |
| 9399 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/B LYS 279 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DA 48 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/B LYS 279 H 3.110 2.192 |
| 9400 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C LYS 188 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DC 15 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C LYS 188 HZ1 3.176 2.193 |
| 9401 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 219 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DA 50 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 219 H 3.467 2.499 |
| 9402 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 219 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 49 OP2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 219 HH11 3.015 2.053 |
| 9403 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 220 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DT 13 O2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 220 HH11 3.388 2.481 |
| 9404 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 220 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 49 O2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 220 HH11 3.296 2.935 |
| 9405 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C TYR 223 OH ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DG 14 O3' ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C TYR 223 HH 3.522 2.887 |
| 9406 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C TYR 223 OH ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DC 15 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C TYR 223 HH 2.762 1.806 |
| 9407 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C TYR 607 OH ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DC 29 OP2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C TYR 607 HH 3.098 2.200 |
| 9408 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C LYS 671 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DC 29 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C LYS 671 H 3.429 2.701 |
| 9409 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 672 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DC 29 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 672 H 3.388 2.439 |
| 9410 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 672 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 34 O2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 672 HH12 2.806 1.902 |
| 9411 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 672 NH2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 34 O2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 672 HH22 2.902 2.042 |
| 9412 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 672 NH2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 34 O4' ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 672 HH22 3.185 2.472 |
| 9413 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C LYS 673 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DT 30 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C LYS 673 HZ1 3.030 2.116 |
| 9414 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D LYS 168 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DT 11 O2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D LYS 168 HZ1 2.564 2.050 |
| 9415 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D SER 169 OG ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DA 12 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D SER 169 HG 3.284 2.325 |
| 9416 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D SER 463 OG ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 39 OP2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D SER 463 HG 2.803 1.844 |
| 9417 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D LYS 465 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 40 N7 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D LYS 465 HZ1 3.514 2.654 |
| 9418 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D LYS 465 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 40 O6 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D LYS 465 HZ1 3.045 2.260 |
| 9419 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D LYS 465 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 41 O6 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D LYS 465 HZ2 3.189 2.368 |
| 9420 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 76 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DG 14 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 76 HH11 2.908 2.005 |
| 9421 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 340 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DA 28 OP2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 340 HH11 3.135 2.272 |
| 9422 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 356 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 27 OP2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 356 HH11 2.946 2.163 |
| 9423 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 357 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 27 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 357 H 3.073 2.081 |
| 9424 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 357 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 25 O2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 357 HH12 2.761 1.945 |
| 9425 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 357 NH2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 25 O2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 357 HH22 2.690 1.846 |
| 9426 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E GLU 358 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DG 38 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E GLU 358 H 3.275 2.276 |
| 9427 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E THR 359 OG1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DA 28 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E THR 359 HG1 2.552 1.830 |
| 9428 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 362 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DA 28 O3' ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 362 H 3.515 2.618 |
| 9429 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 362 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 29 OP2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 362 H 2.892 2.000 |
| 9430 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 362 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DC 35 O4' ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 362 HH12 3.369 2.780 |
| 9431 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 362 NH2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DC 35 O2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 362 HH22 3.076 2.066 |
| 9432 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 362 NH2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DA 36 O4' ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 362 HH21 3.065 2.496 |
| 9433 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E LYS 363 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 29 OP2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E LYS 363 H 3.221 2.221 |
| 9434 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E LYS 363 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 30 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E LYS 363 HZ3 2.954 2.284 |
| 9435 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E LYS 363 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 30 OP2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E LYS 363 HZ1 2.890 1.985 |
| 9436 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G GLY 546 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DT 24 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G GLY 546 H 3.276 2.580 |
| 9437 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LYS 547 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 41 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LYS 547 HZ1 3.303 2.294 |
| 9438 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LYS 548 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DT 24 O2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LYS 548 HZ1 2.747 2.031 |
| 9439 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LYS 548 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DC 25 O4' ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LYS 548 HZ2 2.889 2.196 |
| 9440 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LYS 548 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 38 O2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LYS 548 HZ3 3.045 2.142 |
| 9441 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ASN 553 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 41 OP2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ASN 553 H 3.220 2.217 |
| 9442 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ARG 557 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 44 N7 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ARG 557 HH12 3.403 2.708 |
| 9443 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ARG 557 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 44 O6 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ARG 557 HH12 2.566 1.988 |
| 9444 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ARG 557 NH2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 44 N7 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ARG 557 HH22 3.082 2.292 |
| 9445 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LYS 560 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DA 12 OP2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LYS 560 HZ1 2.981 2.268 |
| 9446 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G GLY 561 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DT 13 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G GLY 561 H 2.977 2.057 |
| 9447 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G THR 563 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DT 13 OP2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G THR 563 H 3.051 2.249 |
| 9448 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ALA 565 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DG 14 OP2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ALA 565 H 3.032 2.059 |
| 9449 | | |
| 9450 | | |
| 9451 | | |
| 9452 | | 54 hydrogen bonds found |
| 9453 | | 8 strict hydrogen bonds found |
| 9454 | | |
| 9455 | | > hide #!1 models |
| 9456 | | |
| 9457 | | > show #!1 models |
| 9458 | | |
| 9459 | | > hide #!1 models |
| 9460 | | |
| 9461 | | > select #2 & nucleic |
| 9462 | | |
| 9463 | | 2158 atoms, 2326 bonds, 68 residues, 1 model selected |
| 9464 | | |
| 9465 | | > show sel atoms |
| 9466 | | |
| 9467 | | > select clear |
| 9468 | | |
| 9469 | | > select #2 & nucleic |
| 9470 | | |
| 9471 | | 2158 atoms, 2326 bonds, 68 residues, 1 model selected |
| 9472 | | |
| 9473 | | > hbonds sel dashes 6 restrict #2/A,B,C,D,E,F,G distSlop 0.5 twoColors true |
| 9474 | | > slopColor #00f900 intraRes false select true reveal true retainCurrent true |
| 9475 | | > log true |
| 9476 | | |
| 9477 | | |
| 9478 | | Finding intermodel H-bonds |
| 9479 | | Finding intramodel H-bonds |
| 9480 | | Constraints relaxed by 0.5 angstroms and 20 degrees |
| 9481 | | Models used: |
| 9482 | | 2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb |
| 9483 | | |
| 9484 | | 42 H-bonds |
| 9485 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 9486 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/A ASN 436 ND2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DA 10 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/A ASN 436 HD22 2.810 1.833 |
| 9487 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/B LYS 148 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DA 28 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/B LYS 148 HZ3 3.208 2.369 |
| 9488 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/B LYS 279 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DA 48 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/B LYS 279 H 3.110 2.192 |
| 9489 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C LYS 188 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DC 15 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C LYS 188 HZ1 3.176 2.193 |
| 9490 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 219 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DA 50 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 219 H 3.467 2.499 |
| 9491 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 219 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 49 OP2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 219 HH11 3.015 2.053 |
| 9492 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 220 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DT 13 O2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 220 HH11 3.388 2.481 |
| 9493 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C TYR 223 OH ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DC 15 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C TYR 223 HH 2.762 1.806 |
| 9494 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C TYR 607 OH ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DC 29 OP2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C TYR 607 HH 3.098 2.200 |
| 9495 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C LYS 671 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DC 29 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C LYS 671 H 3.429 2.701 |
| 9496 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 672 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DC 29 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 672 H 3.388 2.439 |
| 9497 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 672 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 34 O2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 672 HH12 2.806 1.902 |
| 9498 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 672 NH2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 34 O2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 672 HH22 2.902 2.042 |
| 9499 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 672 NH2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 34 O4' ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C ARG 672 HH22 3.185 2.472 |
| 9500 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C LYS 673 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DT 30 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/C LYS 673 HZ1 3.030 2.116 |
| 9501 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D SER 169 OG ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DA 12 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D SER 169 HG 3.284 2.325 |
| 9502 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D SER 463 OG ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 39 OP2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D SER 463 HG 2.803 1.844 |
| 9503 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D LYS 465 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 40 N7 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D LYS 465 HZ1 3.514 2.654 |
| 9504 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D LYS 465 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 40 O6 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D LYS 465 HZ1 3.045 2.260 |
| 9505 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D LYS 465 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 41 O6 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/D LYS 465 HZ2 3.189 2.368 |
| 9506 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 76 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DG 14 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 76 HH11 2.908 2.005 |
| 9507 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 340 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DA 28 OP2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 340 HH11 3.135 2.272 |
| 9508 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 356 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 27 OP2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 356 HH11 2.946 2.163 |
| 9509 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 357 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 27 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 357 H 3.073 2.081 |
| 9510 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 357 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 25 O2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 357 HH12 2.761 1.945 |
| 9511 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 357 NH2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 25 O2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 357 HH22 2.690 1.846 |
| 9512 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E GLU 358 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DG 38 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E GLU 358 H 3.275 2.276 |
| 9513 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E THR 359 OG1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DA 28 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E THR 359 HG1 2.552 1.830 |
| 9514 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 362 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DA 28 O3' ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 362 H 3.515 2.618 |
| 9515 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 362 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 29 OP2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 362 H 2.892 2.000 |
| 9516 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 362 NH2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DC 35 O2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E ARG 362 HH22 3.076 2.066 |
| 9517 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E LYS 363 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 29 OP2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E LYS 363 H 3.221 2.221 |
| 9518 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E LYS 363 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 30 OP2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/E LYS 363 HZ1 2.890 1.985 |
| 9519 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LYS 547 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 41 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LYS 547 HZ1 3.303 2.294 |
| 9520 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LYS 548 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DT 24 O2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LYS 548 HZ1 2.747 2.031 |
| 9521 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LYS 548 NZ ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DT 38 O2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G LYS 548 HZ3 3.045 2.142 |
| 9522 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ASN 553 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 41 OP2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ASN 553 H 3.220 2.217 |
| 9523 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ARG 557 NH1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 44 N7 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ARG 557 HH12 3.403 2.708 |
| 9524 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ARG 557 NH2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/I DG 44 N7 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ARG 557 HH22 3.082 2.292 |
| 9525 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G GLY 561 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DT 13 OP1 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G GLY 561 H 2.977 2.057 |
| 9526 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G THR 563 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DT 13 OP2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G THR 563 H 3.051 2.249 |
| 9527 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ALA 565 N ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/H DG 14 OP2 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #2/G ALA 565 H 3.032 2.059 |
| 9528 | | |
| 9529 | | |
| 9530 | | |
| 9531 | | 42 hydrogen bonds found |
| 9532 | | 8 strict hydrogen bonds found |
| 9533 | | |
| 9534 | | > select clear |
| 9535 | | |
| 9536 | | > select #2/A:301@HH12 |
| 9537 | | |
| 9538 | | 1 atom, 1 residue, 1 model selected |
| 9539 | | |
| 9540 | | > show #!1 models |
| 9541 | | |
| 9542 | | > hide #!2 models |
| 9543 | | |
| 9544 | | > show #!2 models |
| 9545 | | |
| 9546 | | > hide #!2 models |
| 9547 | | |
| 9548 | | > show #!2 models |
| 9549 | | |
| 9550 | | > hide #!2 models |
| 9551 | | |
| 9552 | | > show #!2 models |
| 9553 | | |
| 9554 | | > hide #!2 models |
| 9555 | | |
| 9556 | | > show #!2 models |
| 9557 | | |
| 9558 | | > hide #!1 models |
| 9559 | | |
| 9560 | | > show #!1 models |
| 9561 | | |
| 9562 | | > hide #!1 models |
| 9563 | | |
| 9564 | | > show #!1 models |
| 9565 | | |
| 9566 | | > hide #!2 models |
| 9567 | | |
| 9568 | | > show #!2 models |
| 9569 | | |
| 9570 | | > hide #!2 models |
| 9571 | | |
| 9572 | | > show #!2 models |
| 9573 | | |
| 9574 | | > hide #!2 models |
| 9575 | | |
| 9576 | | > show #!2 models |
| 9577 | | |
| 9578 | | > hide #!1 models |
| 9579 | | |
| 9580 | | > show #!1 models |
| 9581 | | |
| 9582 | | > hide #!1 models |
| 9583 | | |
| 9584 | | > show #!1 models |
| 9585 | | |
| 9586 | | > hide #!1 models |
| 9587 | | |
| 9588 | | > show #!1 models |
| 9589 | | |
| 9590 | | > hide #!1 models |
| 9591 | | |
| 9592 | | > show #!1 models |
| 9593 | | |
| 9594 | | > hide #!1 models |
| 9595 | | |
| 9596 | | > show #!1 models |
| 9597 | | |
| 9598 | | > hide #!1 models |
| 9599 | | |
| 9600 | | > show #!1 models |
| 9601 | | |
| 9602 | | > hide #!1 models |
| 9603 | | |
| 9604 | | > show #!1 models |
| 9605 | | |
| 9606 | | > hide #!1 models |
| 9607 | | |
| 9608 | | > show #!1 models |
| 9609 | | |
| 9610 | | > hide #!2 models |
| 9611 | | |
| 9612 | | > select #1/opp:16 |
| 9613 | | |
| 9614 | | 33 atoms, 35 bonds, 1 residue, 1 model selected |
| 9615 | | |
| 9616 | | > select #1/D:168@NZ |
| 9617 | | |
| 9618 | | 1 atom, 1 residue, 1 model selected |
| 9619 | | |
| 9620 | | > undo |
| 9621 | | |
| 9622 | | > show #!2 models |
| 9623 | | |
| 9624 | | > hide #!2 models |
| 9625 | | |
| 9626 | | > show #!2 models |
| 9627 | | |
| 9628 | | > hide #!2 models |
| 9629 | | |
| 9630 | | > show #!2 models |
| 9631 | | |
| 9632 | | > hide #!2 models |
| 9633 | | |
| 9634 | | > show #!2 models |
| 9635 | | |
| 9636 | | > hide #!2 models |
| 9637 | | |
| 9638 | | > show #!2 models |
| 9639 | | |
| 9640 | | > hide #!2 models |
| 9641 | | |
| 9642 | | > show #!2 models |
| 9643 | | |
| 9644 | | > hide #!2 models |
| 9645 | | |
| 9646 | | > select #1/main:-10 |
| 9647 | | |
| 9648 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 9649 | | |
| 9650 | | > select #1/main:-11 |
| 9651 | | |
| 9652 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 9653 | | |
| 9654 | | > hide sel cartoons |
| 9655 | | |
| 9656 | | > show sel cartoons |
| 9657 | | |
| 9658 | | > select clear |
| 9659 | | |
| 9660 | | > select #1/main:-9 |
| 9661 | | |
| 9662 | | 33 atoms, 35 bonds, 1 residue, 1 model selected |
| 9663 | | |
| 9664 | | > select #1/main:-8 |
| 9665 | | |
| 9666 | | 30 atoms, 31 bonds, 1 residue, 1 model selected |
| 9667 | | |
| 9668 | | > show #!2 models |
| 9669 | | |
| 9670 | | > hide #!2 models |
| 9671 | | |
| 9672 | | > show #!2 models |
| 9673 | | |
| 9674 | | > hide #!2 models |
| 9675 | | |
| 9676 | | > select #1/B:280@CA |
| 9677 | | |
| 9678 | | 1 atom, 1 residue, 1 model selected |
| 9679 | | |
| 9680 | | > select #1/opp:9 |
| 9681 | | |
| 9682 | | 30 atoms, 31 bonds, 1 residue, 1 model selected |
| 9683 | | |
| 9684 | | > select #1/opp:10 |
| 9685 | | |
| 9686 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 9687 | | |
| 9688 | | > hide sel cartoons |
| 9689 | | |
| 9690 | | > show #!2 models |
| 9691 | | |
| 9692 | | > hide #!1 models |
| 9693 | | |
| 9694 | | > hide #!2 models |
| 9695 | | |
| 9696 | | > show #!1 models |
| 9697 | | |
| 9698 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 9699 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 9700 | | > structures/PDBs/ylODC_oriA006_complete/ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb" |
| 9701 | | |
| 9702 | | Chain information for ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3 |
| 9703 | | --- |
| 9704 | | Chain | Description |
| 9705 | | A | No description available |
| 9706 | | B | No description available |
| 9707 | | C | No description available |
| 9708 | | D | No description available |
| 9709 | | E | No description available |
| 9710 | | F | No description available |
| 9711 | | G | No description available |
| 9712 | | H | No description available |
| 9713 | | I | No description available |
| 9714 | | |
| 9715 | | |
| 9716 | | > hide #3 |
| 9717 | | |
| 9718 | | > show #3/B:248 |
| 9719 | | |
| 9720 | | > style sel stick |
| 9721 | | |
| 9722 | | Changed 32 atom styles |
| 9723 | | |
| 9724 | | > style sel stick |
| 9725 | | |
| 9726 | | Changed 32 atom styles |
| 9727 | | |
| 9728 | | > style sel stick |
| 9729 | | |
| 9730 | | Changed 32 atom styles |
| 9731 | | |
| 9732 | | > select clear |
| 9733 | | |
| 9734 | | > select add #3 |
| 9735 | | |
| 9736 | | 24882 atoms, 25492 bonds, 16 pseudobonds, 3000 residues, 3 models selected |
| 9737 | | |
| 9738 | | > style sel stick |
| 9739 | | |
| 9740 | | Changed 24882 atom styles |
| 9741 | | |
| 9742 | | > color sel byhetero |
| 9743 | | |
| 9744 | | > select #1/opp:9 |
| 9745 | | |
| 9746 | | 30 atoms, 31 bonds, 1 residue, 1 model selected |
| 9747 | | |
| 9748 | | > select #3/B:248@CE |
| 9749 | | |
| 9750 | | 1 atom, 1 residue, 1 model selected |
| 9751 | | |
| 9752 | | > select up |
| 9753 | | |
| 9754 | | 9 atoms, 8 bonds, 1 residue, 1 model selected |
| 9755 | | |
| 9756 | | > hbonds sel dashes 6 restrict #3/H,I distSlop 0.5 angleSlop 40.0 twoColors |
| 9757 | | > true slopColor #00f900 intraRes false select true reveal true retainCurrent |
| 9758 | | > true log true |
| 9759 | | |
| 9760 | | |
| 9761 | | Finding intermodel H-bonds |
| 9762 | | Finding intramodel H-bonds |
| 9763 | | Constraints relaxed by 0.5 angstroms and 40 degrees |
| 9764 | | Models used: |
| 9765 | | 3 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb |
| 9766 | | |
| 9767 | | 0 H-bonds |
| 9768 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 9769 | | |
| 9770 | | |
| 9771 | | |
| 9772 | | 0 hydrogen bonds found |
| 9773 | | 0 strict hydrogen bonds found |
| 9774 | | |
| 9775 | | > select #3/B:248@CE |
| 9776 | | |
| 9777 | | 1 atom, 1 residue, 1 model selected |
| 9778 | | |
| 9779 | | > select up |
| 9780 | | |
| 9781 | | 9 atoms, 8 bonds, 1 residue, 1 model selected |
| 9782 | | |
| 9783 | | > hbonds sel dashes 6 restrict #3/H,I distSlop 0.5 angleSlop 40.0 twoColors |
| 9784 | | > true slopColor #00f900 intraRes false select true reveal true retainCurrent |
| 9785 | | > true log true |
| 9786 | | |
| 9787 | | |
| 9788 | | Finding intermodel H-bonds |
| 9789 | | Finding intramodel H-bonds |
| 9790 | | Constraints relaxed by 0.5 angstroms and 40 degrees |
| 9791 | | Models used: |
| 9792 | | 3 ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb |
| 9793 | | |
| 9794 | | 0 H-bonds |
| 9795 | | H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): |
| 9796 | | |
| 9797 | | |
| 9798 | | |
| 9799 | | 0 hydrogen bonds found |
| 9800 | | 0 strict hydrogen bonds found |
| 9801 | | |
| 9802 | | > select #1/opp:9 |
| 9803 | | |
| 9804 | | 30 atoms, 31 bonds, 1 residue, 1 model selected |
| 9805 | | |
| 9806 | | > hide sel cartoons |
| 9807 | | |
| 9808 | | > select #3/B:248@CE |
| 9809 | | |
| 9810 | | 1 atom, 1 residue, 1 model selected |
| 9811 | | |
| 9812 | | > select up |
| 9813 | | |
| 9814 | | 9 atoms, 8 bonds, 1 residue, 1 model selected |
| 9815 | | |
| 9816 | | > ui tool show "Add Hydrogens" |
| 9817 | | |
| 9818 | | > addh #!3 |
| 9819 | | |
| 9820 | | Summary of feedback from adding hydrogens to |
| 9821 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3 |
| 9822 | | --- |
| 9823 | | warning | Not adding hydrogens to ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/I DA 22 P because it is missing heavy-atom bond partners |
| 9824 | | notes | No usable SEQRES records for ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb (#3) chain A; guessing termini instead |
| 9825 | | No usable SEQRES records for ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb (#3) |
| 9826 | | chain B; guessing termini instead |
| 9827 | | No usable SEQRES records for ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb (#3) |
| 9828 | | chain C; guessing termini instead |
| 9829 | | No usable SEQRES records for ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb (#3) |
| 9830 | | chain D; guessing termini instead |
| 9831 | | No usable SEQRES records for ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb (#3) |
| 9832 | | chain E; guessing termini instead |
| 9833 | | 4 messages similar to the above omitted |
| 9834 | | Chain-initial residues that are actual N termini: |
| 9835 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/A PRO 299, |
| 9836 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/B PRO 106, |
| 9837 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/C THR 6, |
| 9838 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/D PRO 33, |
| 9839 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/E MET 1, |
| 9840 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/F PRO 179, |
| 9841 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/G PRO 93 |
| 9842 | | Chain-initial residues that are not actual N termini: |
| 9843 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/B VAL 396, |
| 9844 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/B VAL 444, |
| 9845 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/B LYS 489, |
| 9846 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/C ASN 72, |
| 9847 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/D ASN 128, |
| 9848 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/D GLY 162, |
| 9849 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/D LEU 296, |
| 9850 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/D PHE 436, |
| 9851 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/E GLU 217, |
| 9852 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/E ASP 319, |
| 9853 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/F SER 313, |
| 9854 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/G ALA 213, |
| 9855 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/G THR 386, |
| 9856 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/G VAL 439, |
| 9857 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/G ASN 461 |
| 9858 | | Chain-final residues that are actual C termini: |
| 9859 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/A LEU 718, |
| 9860 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/C LEU 685 |
| 9861 | | Chain-final residues that are not actual C termini: |
| 9862 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/B GLU 504, |
| 9863 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/B GLU 386, |
| 9864 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/B HIS 420, |
| 9865 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/B VAL 479, |
| 9866 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/C ARG 29, |
| 9867 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/D ARG 510, |
| 9868 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/D SER 123, |
| 9869 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/D LEU 159, |
| 9870 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/D MET 285, |
| 9871 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/D LEU 420, |
| 9872 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/E ASN 464, |
| 9873 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/E ALA 210, |
| 9874 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/E LEU 304, |
| 9875 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/F GLN 351, |
| 9876 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/F THR 307, |
| 9877 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/G LEU 604, |
| 9878 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/G GLY 207, |
| 9879 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/G HIS 335, |
| 9880 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/G GLN 433, |
| 9881 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/G PHE 457 |
| 9882 | | 2713 hydrogen bonds |
| 9883 | | Adding 'H' to ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/B VAL 396 |
| 9884 | | Adding 'H' to ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/B VAL 444 |
| 9885 | | Adding 'H' to ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/B LYS 489 |
| 9886 | | Adding 'H' to ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/C ASN 72 |
| 9887 | | Adding 'H' to ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/D ASN 128 |
| 9888 | | 10 messages similar to the above omitted |
| 9889 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/B GLU 504 is not terminus, |
| 9890 | | removing H atom from 'C' |
| 9891 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/D ARG 510 is not terminus, |
| 9892 | | removing H atom from 'C' |
| 9893 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/E ASN 464 is not terminus, |
| 9894 | | removing H atom from 'C' |
| 9895 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/F GLN 351 is not terminus, |
| 9896 | | removing H atom from 'C' |
| 9897 | | ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/G LEU 604 is not terminus, |
| 9898 | | removing H atom from 'C' |
| 9899 | | 24328 hydrogens added |
| 9900 | | |
| 9901 | | |
| 9902 | | > select #3/B:248@HZ2 |
| 9903 | | |
| 9904 | | 1 atom, 1 residue, 1 model selected |
| 9905 | | |
| 9906 | | > close #3 |
| 9907 | | |
| 9908 | | > select #1/B:279@N |
| 9909 | | |
| 9910 | | 1 atom, 1 residue, 1 model selected |
| 9911 | | |
| 9912 | | > select #1/opp:10@P |
| 9913 | | |
| 9914 | | 1 atom, 1 residue, 1 model selected |
| 9915 | | |
| 9916 | | > save "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 9917 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 9918 | | > structures/PDBs/ylODC_oriA006_complete/hbond_oriA_ver20-21.cxs" |
| 9919 | | |
| 9920 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 9921 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 9922 | | > structures/PDBs/ylODC_54bp-oriC061_complete/new_hbond_ver31.cxs" |
| 9923 | | |
| 9924 | | opened ChimeraX session |
| 9925 | | |
| 9926 | | > select /opp:3 |
| 9927 | | |
| 9928 | | 33 atoms, 35 bonds, 1 residue, 1 model selected |
| 9929 | | |
| 9930 | | > hide sel cartoons |
| 9931 | | |
| 9932 | | > show sel cartoons |
| 9933 | | |
| 9934 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 9935 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 9936 | | > structures/PDBs/ylODC_oriA006_complete/hbond_oriA_ver20-21.cxs" format |
| 9937 | | > session |
| 9938 | | |
| 9939 | | opened ChimeraX session |
| 9940 | | |
| 9941 | | > select /G:574 |
| 9942 | | |
| 9943 | | 48 atoms, 46 bonds, 2 residues, 2 models selected |
| 9944 | | |
| 9945 | | > show sel & #!1 atoms |
| 9946 | | |
| 9947 | | > select #1/opp:3 |
| 9948 | | |
| 9949 | | 33 atoms, 35 bonds, 1 residue, 1 model selected |
| 9950 | | |
| 9951 | | > hide sel cartoons |
| 9952 | | |
| 9953 | | > select #1/G:543@N |
| 9954 | | |
| 9955 | | 1 atom, 1 residue, 1 model selected |
| 9956 | | |
| 9957 | | > show #!2 models |
| 9958 | | |
| 9959 | | > hide #!1 models |
| 9960 | | |
| 9961 | | > select #2/H:23 |
| 9962 | | |
| 9963 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 9964 | | |
| 9965 | | > hide sel cartoons |
| 9966 | | |
| 9967 | | > select #2/G:542@OG1 |
| 9968 | | |
| 9969 | | 1 atom, 1 residue, 1 model selected |
| 9970 | | |
| 9971 | | > hide #!2 models |
| 9972 | | |
| 9973 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 9974 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 9975 | | > structures/PDBs/ylODC_54bp-oriC061_complete/new_hbond_ver31.cxs" |
| 9976 | | |
| 9977 | | opened ChimeraX session |
| 9978 | | |
| 9979 | | > select /G:542 |
| 9980 | | |
| 9981 | | 14 atoms, 13 bonds, 1 residue, 1 model selected |
| 9982 | | |
| 9983 | | > show sel atoms |
| 9984 | | |
| 9985 | | > select /main:-1 |
| 9986 | | |
| 9987 | | 30 atoms, 31 bonds, 1 residue, 1 model selected |
| 9988 | | |
| 9989 | | > select /main:0 |
| 9990 | | |
| 9991 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 9992 | | |
| 9993 | | > hide sel cartoons |
| 9994 | | |
| 9995 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 9996 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 9997 | | > structures/PDBs/ylODC_oriA006_complete/hbond_oriA_ver20.cxs" format session |
| 9998 | | |
| 9999 | | opened ChimeraX session |
| 10000 | | |
| 10001 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 10002 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 10003 | | > structures/PDBs/ylODC_oriA006_complete/hbond_oriA_ver20-21.cxs" format |
| 10004 | | > session |
| 10005 | | |
| 10006 | | opened ChimeraX session |
| 10007 | | |
| 10008 | | > show #!2 models |
| 10009 | | |
| 10010 | | > hide #!1 models |
| 10011 | | |
| 10012 | | > select /G:542 |
| 10013 | | |
| 10014 | | 28 atoms, 26 bonds, 2 residues, 2 models selected |
| 10015 | | |
| 10016 | | > show sel & #!2 atoms |
| 10017 | | |
| 10018 | | > select /G:543 |
| 10019 | | |
| 10020 | | 14 atoms, 12 bonds, 2 residues, 2 models selected |
| 10021 | | |
| 10022 | | > show sel & #!2 atoms |
| 10023 | | |
| 10024 | | > select clear |
| 10025 | | |
| 10026 | | > select #2/H:22 |
| 10027 | | |
| 10028 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 10029 | | |
| 10030 | | > show sel cartoons |
| 10031 | | |
| 10032 | | > hide sel cartoons |
| 10033 | | |
| 10034 | | > show sel cartoons |
| 10035 | | |
| 10036 | | > select #2/H:23 |
| 10037 | | |
| 10038 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 10039 | | |
| 10040 | | > hide sel cartoons |
| 10041 | | |
| 10042 | | > show sel cartoons |
| 10043 | | |
| 10044 | | > show #!1 models |
| 10045 | | |
| 10046 | | > hide #!2 models |
| 10047 | | |
| 10048 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 10049 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 10050 | | > structures/PDBs/ylODC_54bp-oriC061_complete/new_hbond_ver31.cxs" format |
| 10051 | | > session |
| 10052 | | |
| 10053 | | opened ChimeraX session |
| 10054 | | |
| 10055 | | > select /main:0 |
| 10056 | | |
| 10057 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 10058 | | |
| 10059 | | > hide sel cartoons |
| 10060 | | |
| 10061 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 10062 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 10063 | | > structures/PDBs/ylODC_oriA006_complete/hbond_oriA_ver20-21.cxs" format |
| 10064 | | > session |
| 10065 | | |
| 10066 | | opened ChimeraX session |
| 10067 | | |
| 10068 | | > select #1/G:581@NZ |
| 10069 | | |
| 10070 | | 1 atom, 1 residue, 1 model selected |
| 10071 | | |
| 10072 | | > select add #1/main:0@OP2 |
| 10073 | | |
| 10074 | | 2 atoms, 2 residues, 1 model selected |
| 10075 | | |
| 10076 | | > ui tool show Distances |
| 10077 | | |
| 10078 | | > distance #1/G:581@NZ #1/main:0@OP2 |
| 10079 | | |
| 10080 | | Distance between ARMori_ODC_ver20_DNAchainfix_PostPhenix.pdb #1/G LYS 581 NZ |
| 10081 | | and /main DA 0 OP2: 5.033Å |
| 10082 | | |
| 10083 | | > select #1/G:581@NZ |
| 10084 | | |
| 10085 | | 1 atom, 1 residue, 1 model selected |
| 10086 | | |
| 10087 | | > select add #1/main:0@OP1 |
| 10088 | | |
| 10089 | | 2 atoms, 2 residues, 1 model selected |
| 10090 | | |
| 10091 | | > distance #1/G:581@NZ #1/main:0@OP1 |
| 10092 | | |
| 10093 | | Distance between ARMori_ODC_ver20_DNAchainfix_PostPhenix.pdb #1/G LYS 581 NZ |
| 10094 | | and /main DA 0 OP1: 4.742Å |
| 10095 | | |
| 10096 | | > ~distance #1/G:581@NZ #1/main:0@OP1 |
| 10097 | | |
| 10098 | | > ~distance #1/G:581@NZ #1/main:0@OP2 |
| 10099 | | |
| 10100 | | > show #!2 models |
| 10101 | | |
| 10102 | | > hide #!2 models |
| 10103 | | |
| 10104 | | > select add #1 |
| 10105 | | |
| 10106 | | 49210 atoms, 49820 bonds, 69 pseudobonds, 3000 residues, 4 models selected |
| 10107 | | |
| 10108 | | > select subtract #1 |
| 10109 | | |
| 10110 | | Nothing selected |
| 10111 | | |
| 10112 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 10113 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 10114 | | > structures/PDBs/ylODC_oriA006_complete/ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb" |
| 10115 | | |
| 10116 | | Chain information for ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3 |
| 10117 | | --- |
| 10118 | | Chain | Description |
| 10119 | | A | No description available |
| 10120 | | B | No description available |
| 10121 | | C | No description available |
| 10122 | | D | No description available |
| 10123 | | E | No description available |
| 10124 | | F | No description available |
| 10125 | | G | No description available |
| 10126 | | H | No description available |
| 10127 | | I | No description available |
| 10128 | | |
| 10129 | | |
| 10130 | | > hide #3 |
| 10131 | | |
| 10132 | | > select /G:548 |
| 10133 | | |
| 10134 | | 53 atoms, 50 bonds, 3 residues, 3 models selected |
| 10135 | | |
| 10136 | | > select /G:581 |
| 10137 | | |
| 10138 | | 53 atoms, 50 bonds, 3 residues, 3 models selected |
| 10139 | | |
| 10140 | | > show sel & #!1,3 atoms |
| 10141 | | |
| 10142 | | > style sel & #!1,3 stick |
| 10143 | | |
| 10144 | | Changed 31 atom styles |
| 10145 | | |
| 10146 | | > select #3/G:581@NZ |
| 10147 | | |
| 10148 | | 1 atom, 1 residue, 1 model selected |
| 10149 | | |
| 10150 | | > select add #1/main:0@OP1 |
| 10151 | | |
| 10152 | | 2 atoms, 2 residues, 2 models selected |
| 10153 | | |
| 10154 | | > distance #3/G:581@NZ #1/main:0@OP1 |
| 10155 | | |
| 10156 | | Distance between ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/G LYS 581 NZ |
| 10157 | | and ARMori_ODC_ver20_DNAchainfix_PostPhenix.pdb #1/main DA 0 OP1: 4.358Å |
| 10158 | | |
| 10159 | | > select #3/G:581@NZ |
| 10160 | | |
| 10161 | | 1 atom, 1 residue, 1 model selected |
| 10162 | | |
| 10163 | | > select add #1/main:0@OP2 |
| 10164 | | |
| 10165 | | 2 atoms, 2 residues, 2 models selected |
| 10166 | | |
| 10167 | | > distance #3/G:581@NZ #1/main:0@OP2 |
| 10168 | | |
| 10169 | | Distance between ARMori_ODC_ver21_DNAchainfix_PostPhenix.pdb #3/G LYS 581 NZ |
| 10170 | | and ARMori_ODC_ver20_DNAchainfix_PostPhenix.pdb #1/main DA 0 OP2: 4.621Å |
| 10171 | | |
| 10172 | | > ~distance #3/G:581@NZ #1/main:0@OP2 |
| 10173 | | |
| 10174 | | > ~distance #3/G:581@NZ #1/main:0@OP1 |
| 10175 | | |
| 10176 | | > close #3 |
| 10177 | | |
| 10178 | | > select #1/main:6 |
| 10179 | | |
| 10180 | | 30 atoms, 31 bonds, 1 residue, 1 model selected |
| 10181 | | |
| 10182 | | > select #1/main:7 |
| 10183 | | |
| 10184 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 10185 | | |
| 10186 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 10187 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 10188 | | > structures/PDBs/ylODC_54bp-oriC061_complete/new_hbond_ver31.cxs" format |
| 10189 | | > session |
| 10190 | | |
| 10191 | | opened ChimeraX session |
| 10192 | | |
| 10193 | | > select /main:6 |
| 10194 | | |
| 10195 | | 30 atoms, 31 bonds, 1 residue, 1 model selected |
| 10196 | | |
| 10197 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 10198 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 10199 | | > structures/PDBs/ylODC_oriA006_complete/hbond_oriA_ver20-21.cxs" format |
| 10200 | | > session |
| 10201 | | |
| 10202 | | opened ChimeraX session |
| 10203 | | |
| 10204 | | > select #1/main:7 |
| 10205 | | |
| 10206 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 10207 | | |
| 10208 | | > select #1/B:153@CA |
| 10209 | | |
| 10210 | | 1 atom, 1 residue, 1 model selected |
| 10211 | | |
| 10212 | | > select #1/main:8 |
| 10213 | | |
| 10214 | | 30 atoms, 31 bonds, 1 residue, 1 model selected |
| 10215 | | |
| 10216 | | > show sel atoms |
| 10217 | | |
| 10218 | | > hide sel cartoons |
| 10219 | | |
| 10220 | | > select #1/B:153@N |
| 10221 | | |
| 10222 | | 1 atom, 1 residue, 1 model selected |
| 10223 | | |
| 10224 | | > select add #1/main:8@OP1 |
| 10225 | | |
| 10226 | | 2 atoms, 2 residues, 1 model selected |
| 10227 | | |
| 10228 | | > select #1/main:7 |
| 10229 | | |
| 10230 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 10231 | | |
| 10232 | | > hide sel cartoons |
| 10233 | | |
| 10234 | | > select #1/B:153@H |
| 10235 | | |
| 10236 | | 1 atom, 1 residue, 1 model selected |
| 10237 | | |
| 10238 | | > select add #1/main:8@OP1 |
| 10239 | | |
| 10240 | | 2 atoms, 2 residues, 1 model selected |
| 10241 | | |
| 10242 | | > select #1/B:153@N |
| 10243 | | |
| 10244 | | 1 atom, 1 residue, 1 model selected |
| 10245 | | |
| 10246 | | > select add #1/main:8@OP1 |
| 10247 | | |
| 10248 | | 2 atoms, 2 residues, 1 model selected |
| 10249 | | |
| 10250 | | > ui tool show Distances |
| 10251 | | |
| 10252 | | > distance #1/B:153@N #1/main:8@OP1 |
| 10253 | | |
| 10254 | | Distance between ARMori_ODC_ver20_DNAchainfix_PostPhenix.pdb #1/B GLY 153 N |
| 10255 | | and /main DC 8 OP1: 3.580Å |
| 10256 | | |
| 10257 | | > ~distance #1/B:153@N #1/main:8@OP1 |
| 10258 | | |
| 10259 | | > select clear |
| 10260 | | |
| 10261 | | > show #!2 models |
| 10262 | | |
| 10263 | | > hide #!1 models |
| 10264 | | |
| 10265 | | > show #!1 models |
| 10266 | | |
| 10267 | | > hide #!2 models |
| 10268 | | |
| 10269 | | > select #1/B:148@NZ |
| 10270 | | |
| 10271 | | 1 atom, 1 residue, 1 model selected |
| 10272 | | |
| 10273 | | > select #1/opp:-10 |
| 10274 | | |
| 10275 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 10276 | | |
| 10277 | | > select #1/opp:-9 |
| 10278 | | |
| 10279 | | 33 atoms, 35 bonds, 1 residue, 1 model selected |
| 10280 | | |
| 10281 | | > hide sel cartoons |
| 10282 | | |
| 10283 | | > select #1/opp:-10 |
| 10284 | | |
| 10285 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 10286 | | |
| 10287 | | > select #1/opp:-11 |
| 10288 | | |
| 10289 | | 32 atoms, 33 bonds, 1 residue, 1 model selected |
| 10290 | | |
| 10291 | | > select #1/opp:-10 |
| 10292 | | |
| 10293 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 10294 | | |
| 10295 | | > hide sel cartoons |
| 10296 | | |
| 10297 | | > select #1/E:358@N |
| 10298 | | |
| 10299 | | 1 atom, 1 residue, 1 model selected |
| 10300 | | |
| 10301 | | > select #1/main:-13 |
| 10302 | | |
| 10303 | | 32 atoms, 34 bonds, 1 residue, 1 model selected |
| 10304 | | |
| 10305 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 10306 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 10307 | | > structures/PDBs/ylODC_54bp-oriC061_complete/new_hbond_ver31.cxs" format |
| 10308 | | > session |
| 10309 | | |
| 10310 | | opened ChimeraX session |
| 10311 | | |
| 10312 | | > select /main:-14 |
| 10313 | | |
| 10314 | | 30 atoms, 31 bonds, 1 residue, 1 model selected |
| 10315 | | |
| 10316 | | > select /main:-13 |
| 10317 | | |
| 10318 | | 30 atoms, 31 bonds, 1 residue, 1 model selected |
| 10319 | | |
| 10320 | | > select /opp:18 |
| 10321 | | |
| 10322 | | 31 atoms, 32 bonds, 1 residue, 1 model selected |
| 10323 | | |
| 10324 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 10325 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 10326 | | > structures/PDBs/ylODC_oriA006_complete/hbond_oriA_ver20-21.cxs" format |
| 10327 | | > session |
| 10328 | | |
| 10329 | | opened ChimeraX session |
| 10330 | | |
| 10331 | | > close |
| 10332 | | |
| 10333 | | > open /Users/jtbauer/Library/CloudStorage/OneDrive- |
| 10334 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/7jk3-dmODC_GCrich.pdb |
| 10335 | | |
| 10336 | | 7jk3-dmODC_GCrich.pdb title: |
| 10337 | | Structure of drosophila orc bound to GC-rich DNA and CDC6 [more info...] |
| 10338 | | |
| 10339 | | Chain information for 7jk3-dmODC_GCrich.pdb #1 |
| 10340 | | --- |
| 10341 | | Chain | Description | UniProt |
| 10342 | | A | DMORC1 | ORC1_DROME 440-924 |
| 10343 | | B | DMORC2 | ORC2_DROME 1-618 |
| 10344 | | C | origin recognition complex subunit 3 | Q7K2L1_DROME 1-721 |
| 10345 | | D | ORC4 | Q9W102_DROME 1-459 |
| 10346 | | E | ORC5 | ORC5_DROME 1-460 |
| 10347 | | F | ORC6 | ORC6_DROME 1-257 |
| 10348 | | G | CDC6 | Q9VSM9_DROME 242-662 |
| 10349 | | H | DNA (33-mer) | |
| 10350 | | I | DNA (33-mer) | |
| 10351 | | |
| 10352 | | Non-standard residues in 7jk3-dmODC_GCrich.pdb #1 |
| 10353 | | --- |
| 10354 | | ATP — adenosine-5'-triphosphate |
| 10355 | | MG — magnesium ion |
| 10356 | | |
| 10357 | | |
| 10358 | | > modelfix |
| 10359 | | |
| 10360 | | Changed 21661 atom styles |
| 10361 | | 20180 atoms, 20524 bonds, 18 pseudobonds, 2528 residues, 2 models selected |
| 10362 | | |
| 10363 | | > close #1 |
| 10364 | | |
| 10365 | | > open /Users/jtbauer/Library/CloudStorage/OneDrive- |
| 10366 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/hsORC1-6_CDC6_60bpDNA.pdb |
| 10367 | | > format pdb |
| 10368 | | |
| 10369 | | Chain information for hsORC1-6_CDC6_60bpDNA.pdb #1 |
| 10370 | | --- |
| 10371 | | Chain | Description |
| 10372 | | A | No description available |
| 10373 | | B | No description available |
| 10374 | | C | No description available |
| 10375 | | D | No description available |
| 10376 | | E | No description available |
| 10377 | | F | No description available |
| 10378 | | G | No description available |
| 10379 | | H | No description available |
| 10380 | | I | No description available |
| 10381 | | |
| 10382 | | |
| 10383 | | > modelfix |
| 10384 | | |
| 10385 | | Changed 21416 atom styles |
| 10386 | | 20099 atoms, 20484 bonds, 13 pseudobonds, 2485 residues, 2 models selected |
| 10387 | | Computing secondary structure |
| 10388 | | |
| 10389 | | > open /Users/jtbauer/Library/CloudStorage/OneDrive- |
| 10390 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/7jk3-dmODC_GCrich.pdb format |
| 10391 | | > pdb |
| 10392 | | |
| 10393 | | 7jk3-dmODC_GCrich.pdb title: |
| 10394 | | Structure of drosophila orc bound to GC-rich DNA and CDC6 [more info...] |
| 10395 | | |
| 10396 | | Chain information for 7jk3-dmODC_GCrich.pdb #2 |
| 10397 | | --- |
| 10398 | | Chain | Description | UniProt |
| 10399 | | A | DMORC1 | ORC1_DROME 440-924 |
| 10400 | | B | DMORC2 | ORC2_DROME 1-618 |
| 10401 | | C | origin recognition complex subunit 3 | Q7K2L1_DROME 1-721 |
| 10402 | | D | ORC4 | Q9W102_DROME 1-459 |
| 10403 | | E | ORC5 | ORC5_DROME 1-460 |
| 10404 | | F | ORC6 | ORC6_DROME 1-257 |
| 10405 | | G | CDC6 | Q9VSM9_DROME 242-662 |
| 10406 | | H | DNA (33-mer) | |
| 10407 | | I | DNA (33-mer) | |
| 10408 | | |
| 10409 | | Non-standard residues in 7jk3-dmODC_GCrich.pdb #2 |
| 10410 | | --- |
| 10411 | | ATP — adenosine-5'-triphosphate |
| 10412 | | MG — magnesium ion |
| 10413 | | |
| 10414 | | |
| 10415 | | > modelfix |
| 10416 | | |
| 10417 | | Changed 43077 atom styles |
| 10418 | | 40279 atoms, 41008 bonds, 31 pseudobonds, 5013 residues, 4 models selected |
| 10419 | | |
| 10420 | | > matchmaker #2 to #1 |
| 10421 | | |
| 10422 | | Computing secondary structure |
| 10423 | | Parameters |
| 10424 | | --- |
| 10425 | | Chain pairing | bb |
| 10426 | | Alignment algorithm | Needleman-Wunsch |
| 10427 | | Similarity matrix | BLOSUM-62 |
| 10428 | | SS fraction | 0.3 |
| 10429 | | Gap open (HH/SS/other) | 18/18/6 |
| 10430 | | Gap extend | 1 |
| 10431 | | SS matrix | | | H | S | O |
| 10432 | | ---|---|---|--- |
| 10433 | | H | 6 | -9 | -6 |
| 10434 | | S | | 6 | -6 |
| 10435 | | O | | | 4 |
| 10436 | | Iteration cutoff | 2 |
| 10437 | | |
| 10438 | | Matchmaker hsORC1-6_CDC6_60bpDNA.pdb, chain C (#1) with 7jk3-dmODC_GCrich.pdb, |
| 10439 | | chain C (#2), sequence alignment score = 1256.2 |
| 10440 | | RMSD between 288 pruned atom pairs is 1.187 angstroms; (across all 575 pairs: |
| 10441 | | 4.218) |
| 10442 | | |
| 10443 | | |
| 10444 | | > select #2/G:623 |
| 10445 | | |
| 10446 | | 9 atoms, 8 bonds, 1 residue, 1 model selected |
| 10447 | | |
| 10448 | | > show sel atoms |
| 10449 | | |
| 10450 | | > hide sel atoms |
| 10451 | | |
| 10452 | | > select clear |
| 10453 | | |
| 10454 | | > select #2/C:181 |
| 10455 | | |
| 10456 | | 6 atoms, 5 bonds, 1 residue, 1 model selected |
| 10457 | | |
| 10458 | | > hide #!2 models |
| 10459 | | |
| 10460 | | > hide #!1 models |
| 10461 | | |
| 10462 | | > show #!1 models |
| 10463 | | |
| 10464 | | > select add #2 |
| 10465 | | |
| 10466 | | 21661 atoms, 22172 bonds, 30 pseudobonds, 2602 residues, 3 models selected |
| 10467 | | |
| 10468 | | > select subtract #2 |
| 10469 | | |
| 10470 | | Nothing selected |
| 10471 | | |
| 10472 | | > show #!2 models |
| 10473 | | |
| 10474 | | > hide #!1 models |
| 10475 | | |
| 10476 | | > select #2/C:711 |
| 10477 | | |
| 10478 | | 11 atoms, 10 bonds, 1 residue, 1 model selected |
| 10479 | | |
| 10480 | | > show sel atoms |
| 10481 | | |
| 10482 | | > select #2/C:712 |
| 10483 | | |
| 10484 | | 9 atoms, 8 bonds, 1 residue, 1 model selected |
| 10485 | | |
| 10486 | | > show sel atoms |
| 10487 | | |
| 10488 | | > select #2/C:710 |
| 10489 | | |
| 10490 | | 9 atoms, 8 bonds, 1 residue, 1 model selected |
| 10491 | | |
| 10492 | | > show #!1 models |
| 10493 | | |
| 10494 | | > hide #!2 models |
| 10495 | | |
| 10496 | | > show #!2 models |
| 10497 | | |
| 10498 | | > select clear |
| 10499 | | |
| 10500 | | > matchmaker #2/D to #1/D |
| 10501 | | |
| 10502 | | Computing secondary structure |
| 10503 | | Parameters |
| 10504 | | --- |
| 10505 | | Chain pairing | bb |
| 10506 | | Alignment algorithm | Needleman-Wunsch |
| 10507 | | Similarity matrix | BLOSUM-62 |
| 10508 | | SS fraction | 0.3 |
| 10509 | | Gap open (HH/SS/other) | 18/18/6 |
| 10510 | | Gap extend | 1 |
| 10511 | | SS matrix | | | H | S | O |
| 10512 | | ---|---|---|--- |
| 10513 | | H | 6 | -9 | -6 |
| 10514 | | S | | 6 | -6 |
| 10515 | | O | | | 4 |
| 10516 | | Iteration cutoff | 2 |
| 10517 | | |
| 10518 | | Matchmaker hsORC1-6_CDC6_60bpDNA.pdb, chain D (#1) with 7jk3-dmODC_GCrich.pdb, |
| 10519 | | chain D (#2), sequence alignment score = 1104.3 |
| 10520 | | RMSD between 338 pruned atom pairs is 0.924 angstroms; (across all 410 pairs: |
| 10521 | | 2.005) |
| 10522 | | |
| 10523 | | |
| 10524 | | > select #2/D:410 |
| 10525 | | |
| 10526 | | 7 atoms, 6 bonds, 1 residue, 1 model selected |
| 10527 | | |
| 10528 | | > matchmaker #2/E to #1/E |
| 10529 | | |
| 10530 | | Computing secondary structure |
| 10531 | | Parameters |
| 10532 | | --- |
| 10533 | | Chain pairing | bb |
| 10534 | | Alignment algorithm | Needleman-Wunsch |
| 10535 | | Similarity matrix | BLOSUM-62 |
| 10536 | | SS fraction | 0.3 |
| 10537 | | Gap open (HH/SS/other) | 18/18/6 |
| 10538 | | Gap extend | 1 |
| 10539 | | SS matrix | | | H | S | O |
| 10540 | | ---|---|---|--- |
| 10541 | | H | 6 | -9 | -6 |
| 10542 | | S | | 6 | -6 |
| 10543 | | O | | | 4 |
| 10544 | | Iteration cutoff | 2 |
| 10545 | | |
| 10546 | | Matchmaker hsORC1-6_CDC6_60bpDNA.pdb, chain E (#1) with 7jk3-dmODC_GCrich.pdb, |
| 10547 | | chain E (#2), sequence alignment score = 853.4 |
| 10548 | | RMSD between 290 pruned atom pairs is 1.201 angstroms; (across all 363 pairs: |
| 10549 | | 2.631) |
| 10550 | | |
| 10551 | | |
| 10552 | | > select clear |
| 10553 | | |
| 10554 | | > open /Users/jtbauer/Library/CloudStorage/OneDrive- |
| 10555 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/7mca-assembly1.cif format |
| 10556 | | > mmcif |
| 10557 | | |
| 10558 | | 7mca-assembly1.cif title: |
| 10559 | | Structure of the S. cerevisiae origin recognition complex bound to the |
| 10560 | | replication initiator Cdc6 and the ARS1 origin DNA. [more info...] |
| 10561 | | |
| 10562 | | Chain information for 7mca-assembly1.cif #3 |
| 10563 | | --- |
| 10564 | | Chain | Description |
| 10565 | | A | Origin recognition complex subunit 1 |
| 10566 | | B | Origin recognition complex subunit 2 |
| 10567 | | C | Origin recognition complex subunit 3 |
| 10568 | | D | Origin recognition complex subunit 4 |
| 10569 | | E | Origin recognition complex subunit 5 |
| 10570 | | F | Origin recognition complex subunit 6 |
| 10571 | | G | DNA (85-MER) |
| 10572 | | H | DNA (85-MER) |
| 10573 | | I | Cell division control protein 6 |
| 10574 | | |
| 10575 | | Non-standard residues in 7mca-assembly1.cif #3 |
| 10576 | | --- |
| 10577 | | AGS — phosphothiophosphoric acid-adenylate ester (atp-γ-S; adenosine |
| 10578 | | 5'-(3-thiotriphosphate); adenosine 5'-(γ-thiotriphosphate); |
| 10579 | | adenosine-5'-diphosphate monothiophosphate) |
| 10580 | | MG — magnesium ion |
| 10581 | | |
| 10582 | | |
| 10583 | | > modelfix |
| 10584 | | |
| 10585 | | Changed 67769 atom styles |
| 10586 | | 62793 atoms, 63953 bonds, 45 pseudobonds, 7773 residues, 6 models selected |
| 10587 | | |
| 10588 | | > newcolor #3/A #3/B #3/C #3/D #3/E #3/F #3/I #3/G #3/H |
| 10589 | | |
| 10590 | | > matchmaker /A to #1/A |
| 10591 | | |
| 10592 | | Must use different reference and match structures |
| 10593 | | |
| 10594 | | > matchmaker #2-3/A to #1/A |
| 10595 | | |
| 10596 | | Computing secondary structure |
| 10597 | | Parameters |
| 10598 | | --- |
| 10599 | | Chain pairing | bb |
| 10600 | | Alignment algorithm | Needleman-Wunsch |
| 10601 | | Similarity matrix | BLOSUM-62 |
| 10602 | | SS fraction | 0.3 |
| 10603 | | Gap open (HH/SS/other) | 18/18/6 |
| 10604 | | Gap extend | 1 |
| 10605 | | SS matrix | | | H | S | O |
| 10606 | | ---|---|---|--- |
| 10607 | | H | 6 | -9 | -6 |
| 10608 | | S | | 6 | -6 |
| 10609 | | O | | | 4 |
| 10610 | | Iteration cutoff | 2 |
| 10611 | | |
| 10612 | | Matchmaker hsORC1-6_CDC6_60bpDNA.pdb, chain A (#1) with 7jk3-dmODC_GCrich.pdb, |
| 10613 | | chain A (#2), sequence alignment score = 1245.5 |
| 10614 | | RMSD between 341 pruned atom pairs is 0.995 angstroms; (across all 383 pairs: |
| 10615 | | 1.387) |
| 10616 | | |
| 10617 | | Matchmaker hsORC1-6_CDC6_60bpDNA.pdb, chain A (#1) with 7mca-assembly1.cif, |
| 10618 | | chain A (#3), sequence alignment score = 707.9 |
| 10619 | | RMSD between 295 pruned atom pairs is 1.089 angstroms; (across all 368 pairs: |
| 10620 | | 4.720) |
| 10621 | | |
| 10622 | | |
| 10623 | | > matchmaker #2-3/B to #1/B |
| 10624 | | |
| 10625 | | Computing secondary structure |
| 10626 | | Parameters |
| 10627 | | --- |
| 10628 | | Chain pairing | bb |
| 10629 | | Alignment algorithm | Needleman-Wunsch |
| 10630 | | Similarity matrix | BLOSUM-62 |
| 10631 | | SS fraction | 0.3 |
| 10632 | | Gap open (HH/SS/other) | 18/18/6 |
| 10633 | | Gap extend | 1 |
| 10634 | | SS matrix | | | H | S | O |
| 10635 | | ---|---|---|--- |
| 10636 | | H | 6 | -9 | -6 |
| 10637 | | S | | 6 | -6 |
| 10638 | | O | | | 4 |
| 10639 | | Iteration cutoff | 2 |
| 10640 | | |
| 10641 | | Matchmaker hsORC1-6_CDC6_60bpDNA.pdb, chain B (#1) with 7jk3-dmODC_GCrich.pdb, |
| 10642 | | chain B (#2), sequence alignment score = 879.5 |
| 10643 | | RMSD between 201 pruned atom pairs is 1.032 angstroms; (across all 272 pairs: |
| 10644 | | 2.378) |
| 10645 | | |
| 10646 | | Matchmaker hsORC1-6_CDC6_60bpDNA.pdb, chain B (#1) with 7mca-assembly1.cif, |
| 10647 | | chain B (#3), sequence alignment score = 458.2 |
| 10648 | | RMSD between 130 pruned atom pairs is 0.873 angstroms; (across all 193 pairs: |
| 10649 | | 3.624) |
| 10650 | | |
| 10651 | | |
| 10652 | | > hide #!2 models |
| 10653 | | |
| 10654 | | > hide #!1 models |
| 10655 | | |
| 10656 | | > select #3/C:178 |
| 10657 | | |
| 10658 | | 8 atoms, 7 bonds, 1 residue, 1 model selected |
| 10659 | | |
| 10660 | | > select #3/C:159 |
| 10661 | | |
| 10662 | | 10 atoms, 10 bonds, 1 residue, 1 model selected |
| 10663 | | |
| 10664 | | > select add #3 |
| 10665 | | |
| 10666 | | 24692 atoms, 25375 bonds, 14 pseudobonds, 2868 residues, 2 models selected |
| 10667 | | |
| 10668 | | > hide #!3 models |
| 10669 | | |
| 10670 | | > select subtract #3 |
| 10671 | | |
| 10672 | | Nothing selected |
| 10673 | | |
| 10674 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 10675 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 10676 | | > structures/PDBs/ylODC_54bp- |
| 10677 | | > oriC061_complete/ylODC_54bpOriC061_rev31_PostPhenix.pdb" |
| 10678 | | |
| 10679 | | Chain information for ylODC_54bpOriC061_rev31_PostPhenix.pdb #4 |
| 10680 | | --- |
| 10681 | | Chain | Description |
| 10682 | | A | No description available |
| 10683 | | B | No description available |
| 10684 | | C | No description available |
| 10685 | | D | No description available |
| 10686 | | E | No description available |
| 10687 | | F | No description available |
| 10688 | | G | No description available |
| 10689 | | H | No description available |
| 10690 | | I | No description available |
| 10691 | | |
| 10692 | | |
| 10693 | | > modelfix |
| 10694 | | |
| 10695 | | Changed 93068 atom styles |
| 10696 | | 86492 atoms, 88098 bonds, 54 pseudobonds, 10743 residues, 8 models selected |
| 10697 | | |
| 10698 | | > newcolor #3/A #3/B #3/C #3/D #3/E #3/F #3/I #3/G #3/H |
| 10699 | | |
| 10700 | | > matchmaker #1-3/A to #4 |
| 10701 | | |
| 10702 | | Computing secondary structure |
| 10703 | | Parameters |
| 10704 | | --- |
| 10705 | | Chain pairing | bb |
| 10706 | | Alignment algorithm | Needleman-Wunsch |
| 10707 | | Similarity matrix | BLOSUM-62 |
| 10708 | | SS fraction | 0.3 |
| 10709 | | Gap open (HH/SS/other) | 18/18/6 |
| 10710 | | Gap extend | 1 |
| 10711 | | SS matrix | | | H | S | O |
| 10712 | | ---|---|---|--- |
| 10713 | | H | 6 | -9 | -6 |
| 10714 | | S | | 6 | -6 |
| 10715 | | O | | | 4 |
| 10716 | | Iteration cutoff | 2 |
| 10717 | | |
| 10718 | | Matchmaker ylODC_54bpOriC061_rev31_PostPhenix.pdb, chain A (#4) with |
| 10719 | | hsORC1-6_CDC6_60bpDNA.pdb, chain A (#1), sequence alignment score = 965.4 |
| 10720 | | RMSD between 213 pruned atom pairs is 1.228 angstroms; (across all 381 pairs: |
| 10721 | | 3.152) |
| 10722 | | |
| 10723 | | Matchmaker ylODC_54bpOriC061_rev31_PostPhenix.pdb, chain A (#4) with |
| 10724 | | 7jk3-dmODC_GCrich.pdb, chain A (#2), sequence alignment score = 962.2 |
| 10725 | | RMSD between 250 pruned atom pairs is 1.152 angstroms; (across all 383 pairs: |
| 10726 | | 6.101) |
| 10727 | | |
| 10728 | | Matchmaker ylODC_54bpOriC061_rev31_PostPhenix.pdb, chain A (#4) with 7mca- |
| 10729 | | assembly1.cif, chain A (#3), sequence alignment score = 943 |
| 10730 | | RMSD between 228 pruned atom pairs is 1.005 angstroms; (across all 394 pairs: |
| 10731 | | 5.169) |
| 10732 | | |
| 10733 | | |
| 10734 | | > show #!3 models |
| 10735 | | |
| 10736 | | > show #!2 models |
| 10737 | | |
| 10738 | | > show #!1 models |
| 10739 | | |
| 10740 | | > matchmaker #1-3/A to #4/A |
| 10741 | | |
| 10742 | | Computing secondary structure |
| 10743 | | Parameters |
| 10744 | | --- |
| 10745 | | Chain pairing | bb |
| 10746 | | Alignment algorithm | Needleman-Wunsch |
| 10747 | | Similarity matrix | BLOSUM-62 |
| 10748 | | SS fraction | 0.3 |
| 10749 | | Gap open (HH/SS/other) | 18/18/6 |
| 10750 | | Gap extend | 1 |
| 10751 | | SS matrix | | | H | S | O |
| 10752 | | ---|---|---|--- |
| 10753 | | H | 6 | -9 | -6 |
| 10754 | | S | | 6 | -6 |
| 10755 | | O | | | 4 |
| 10756 | | Iteration cutoff | 2 |
| 10757 | | |
| 10758 | | Matchmaker ylODC_54bpOriC061_rev31_PostPhenix.pdb, chain A (#4) with |
| 10759 | | hsORC1-6_CDC6_60bpDNA.pdb, chain A (#1), sequence alignment score = 965.4 |
| 10760 | | RMSD between 213 pruned atom pairs is 1.228 angstroms; (across all 381 pairs: |
| 10761 | | 3.152) |
| 10762 | | |
| 10763 | | Matchmaker ylODC_54bpOriC061_rev31_PostPhenix.pdb, chain A (#4) with |
| 10764 | | 7jk3-dmODC_GCrich.pdb, chain A (#2), sequence alignment score = 962.2 |
| 10765 | | RMSD between 250 pruned atom pairs is 1.152 angstroms; (across all 383 pairs: |
| 10766 | | 6.101) |
| 10767 | | |
| 10768 | | Matchmaker ylODC_54bpOriC061_rev31_PostPhenix.pdb, chain A (#4) with 7mca- |
| 10769 | | assembly1.cif, chain A (#3), sequence alignment score = 943 |
| 10770 | | RMSD between 228 pruned atom pairs is 1.005 angstroms; (across all 394 pairs: |
| 10771 | | 5.169) |
| 10772 | | |
| 10773 | | |
| 10774 | | > matchmaker #1-3/B to #4/B |
| 10775 | | |
| 10776 | | Computing secondary structure |
| 10777 | | Parameters |
| 10778 | | --- |
| 10779 | | Chain pairing | bb |
| 10780 | | Alignment algorithm | Needleman-Wunsch |
| 10781 | | Similarity matrix | BLOSUM-62 |
| 10782 | | SS fraction | 0.3 |
| 10783 | | Gap open (HH/SS/other) | 18/18/6 |
| 10784 | | Gap extend | 1 |
| 10785 | | SS matrix | | | H | S | O |
| 10786 | | ---|---|---|--- |
| 10787 | | H | 6 | -9 | -6 |
| 10788 | | S | | 6 | -6 |
| 10789 | | O | | | 4 |
| 10790 | | Iteration cutoff | 2 |
| 10791 | | |
| 10792 | | Matchmaker ylODC_54bpOriC061_rev31_PostPhenix.pdb, chain B (#4) with |
| 10793 | | hsORC1-6_CDC6_60bpDNA.pdb, chain B (#1), sequence alignment score = 635.5 |
| 10794 | | RMSD between 137 pruned atom pairs is 1.099 angstroms; (across all 304 pairs: |
| 10795 | | 5.531) |
| 10796 | | |
| 10797 | | Matchmaker ylODC_54bpOriC061_rev31_PostPhenix.pdb, chain B (#4) with |
| 10798 | | 7jk3-dmODC_GCrich.pdb, chain B (#2), sequence alignment score = 558 |
| 10799 | | RMSD between 135 pruned atom pairs is 0.988 angstroms; (across all 284 pairs: |
| 10800 | | 5.027) |
| 10801 | | |
| 10802 | | Matchmaker ylODC_54bpOriC061_rev31_PostPhenix.pdb, chain B (#4) with 7mca- |
| 10803 | | assembly1.cif, chain B (#3), sequence alignment score = 609.7 |
| 10804 | | RMSD between 153 pruned atom pairs is 1.065 angstroms; (across all 237 pairs: |
| 10805 | | 4.405) |
| 10806 | | |
| 10807 | | |
| 10808 | | > select #3/B:396 |
| 10809 | | |
| 10810 | | 14 atoms, 15 bonds, 1 residue, 1 model selected |
| 10811 | | |
| 10812 | | > hide #!2 models |
| 10813 | | |
| 10814 | | > hide #!3 models |
| 10815 | | |
| 10816 | | > hide #!4 models |
| 10817 | | |
| 10818 | | > select #1/B:367 |
| 10819 | | |
| 10820 | | 11 atoms, 10 bonds, 1 residue, 1 model selected |
| 10821 | | |
| 10822 | | > show sel atoms |
| 10823 | | |
| 10824 | | > select #1/B:365 |
| 10825 | | |
| 10826 | | 7 atoms, 6 bonds, 1 residue, 1 model selected |
| 10827 | | |
| 10828 | | > show sel atoms |
| 10829 | | |
| 10830 | | > hide sel atoms |
| 10831 | | |
| 10832 | | > select #1/B:367@CA |
| 10833 | | |
| 10834 | | 1 atom, 1 residue, 1 model selected |
| 10835 | | |
| 10836 | | > hide sel atoms |
| 10837 | | |
| 10838 | | > select #1/B:367 |
| 10839 | | |
| 10840 | | 11 atoms, 10 bonds, 1 residue, 1 model selected |
| 10841 | | |
| 10842 | | > hide sel atoms |
| 10843 | | |
| 10844 | | > select #1/C:177 |
| 10845 | | |
| 10846 | | 7 atoms, 6 bonds, 1 residue, 1 model selected |
| 10847 | | |
| 10848 | | > select clear |
| 10849 | | |
| 10850 | | > show #!4 models |
| 10851 | | |
| 10852 | | > hide #!1 models |
| 10853 | | |
| 10854 | | > select #4/B:150 |
| 10855 | | |
| 10856 | | 11 atoms, 10 bonds, 1 residue, 1 model selected |
| 10857 | | |
| 10858 | | > show sel atoms |
| 10859 | | |
| 10860 | | > select clear |
| 10861 | | |
| 10862 | | > show #!3 models |
| 10863 | | |
| 10864 | | > show #!2 models |
| 10865 | | |
| 10866 | | > show #!1 models |
| 10867 | | |
| 10868 | | > select #3/B:255 |
| 10869 | | |
| 10870 | | 7 atoms, 6 bonds, 1 residue, 1 model selected |
| 10871 | | |
| 10872 | | > select #3/B:254 |
| 10873 | | |
| 10874 | | 11 atoms, 10 bonds, 1 residue, 1 model selected |
| 10875 | | |
| 10876 | | > show sel atoms |
| 10877 | | |
| 10878 | | > hide #!4 models |
| 10879 | | |
| 10880 | | > hide #!2 models |
| 10881 | | |
| 10882 | | > hide #!1 models |
| 10883 | | |
| 10884 | | > select clear |
| 10885 | | |
| 10886 | | > color #!3 byhetero |
| 10887 | | |
| 10888 | | > show #!4 models |
| 10889 | | |
| 10890 | | > matchmaker #1-3/E to #4/E |
| 10891 | | |
| 10892 | | Computing secondary structure |
| 10893 | | Parameters |
| 10894 | | --- |
| 10895 | | Chain pairing | bb |
| 10896 | | Alignment algorithm | Needleman-Wunsch |
| 10897 | | Similarity matrix | BLOSUM-62 |
| 10898 | | SS fraction | 0.3 |
| 10899 | | Gap open (HH/SS/other) | 18/18/6 |
| 10900 | | Gap extend | 1 |
| 10901 | | SS matrix | | | H | S | O |
| 10902 | | ---|---|---|--- |
| 10903 | | H | 6 | -9 | -6 |
| 10904 | | S | | 6 | -6 |
| 10905 | | O | | | 4 |
| 10906 | | Iteration cutoff | 2 |
| 10907 | | |
| 10908 | | Matchmaker ylODC_54bpOriC061_rev31_PostPhenix.pdb, chain E (#4) with |
| 10909 | | hsORC1-6_CDC6_60bpDNA.pdb, chain E (#1), sequence alignment score = 675 |
| 10910 | | RMSD between 179 pruned atom pairs is 1.291 angstroms; (across all 379 pairs: |
| 10911 | | 4.186) |
| 10912 | | |
| 10913 | | Matchmaker ylODC_54bpOriC061_rev31_PostPhenix.pdb, chain E (#4) with |
| 10914 | | 7jk3-dmODC_GCrich.pdb, chain E (#2), sequence alignment score = 567.4 |
| 10915 | | RMSD between 149 pruned atom pairs is 1.290 angstroms; (across all 374 pairs: |
| 10916 | | 4.652) |
| 10917 | | |
| 10918 | | Matchmaker ylODC_54bpOriC061_rev31_PostPhenix.pdb, chain E (#4) with 7mca- |
| 10919 | | assembly1.cif, chain E (#3), sequence alignment score = 646.2 |
| 10920 | | RMSD between 174 pruned atom pairs is 1.399 angstroms; (across all 417 pairs: |
| 10921 | | 4.188) |
| 10922 | | |
| 10923 | | |
| 10924 | | > hide #!4 models |
| 10925 | | |
| 10926 | | > select #3/E:366 |
| 10927 | | |
| 10928 | | 11 atoms, 10 bonds, 1 residue, 1 model selected |
| 10929 | | |
| 10930 | | > show sel atoms |
| 10931 | | |
| 10932 | | > select #3/E:363 |
| 10933 | | |
| 10934 | | 12 atoms, 12 bonds, 1 residue, 1 model selected |
| 10935 | | |
| 10936 | | > select #3/E:360 |
| 10937 | | |
| 10938 | | 11 atoms, 10 bonds, 1 residue, 1 model selected |
| 10939 | | |
| 10940 | | > show sel atoms |
| 10941 | | |
| 10942 | | > show #!4 models |
| 10943 | | |
| 10944 | | > matchmaker #1-3/E to #4/E:307-end |
| 10945 | | |
| 10946 | | Computing secondary structure |
| 10947 | | Parameters |
| 10948 | | --- |
| 10949 | | Chain pairing | bb |
| 10950 | | Alignment algorithm | Needleman-Wunsch |
| 10951 | | Similarity matrix | BLOSUM-62 |
| 10952 | | SS fraction | 0.3 |
| 10953 | | Gap open (HH/SS/other) | 18/18/6 |
| 10954 | | Gap extend | 1 |
| 10955 | | SS matrix | | | H | S | O |
| 10956 | | ---|---|---|--- |
| 10957 | | H | 6 | -9 | -6 |
| 10958 | | S | | 6 | -6 |
| 10959 | | O | | | 4 |
| 10960 | | Iteration cutoff | 2 |
| 10961 | | |
| 10962 | | Matchmaker ylODC_54bpOriC061_rev31_PostPhenix.pdb, chain E (#4) with |
| 10963 | | hsORC1-6_CDC6_60bpDNA.pdb, chain E (#1), sequence alignment score = 281.2 |
| 10964 | | RMSD between 99 pruned atom pairs is 0.965 angstroms; (across all 120 pairs: |
| 10965 | | 3.490) |
| 10966 | | |
| 10967 | | Matchmaker ylODC_54bpOriC061_rev31_PostPhenix.pdb, chain E (#4) with |
| 10968 | | 7jk3-dmODC_GCrich.pdb, chain E (#2), sequence alignment score = 198.4 |
| 10969 | | RMSD between 96 pruned atom pairs is 1.015 angstroms; (across all 110 pairs: |
| 10970 | | 1.673) |
| 10971 | | |
| 10972 | | Matchmaker ylODC_54bpOriC061_rev31_PostPhenix.pdb, chain E (#4) with 7mca- |
| 10973 | | assembly1.cif, chain E (#3), sequence alignment score = 312.4 |
| 10974 | | RMSD between 101 pruned atom pairs is 0.945 angstroms; (across all 138 pairs: |
| 10975 | | 3.466) |
| 10976 | | |
| 10977 | | |
| 10978 | | > select #4/E:362 |
| 10979 | | |
| 10980 | | 11 atoms, 10 bonds, 1 residue, 1 model selected |
| 10981 | | |
| 10982 | | > show sel atoms |
| 10983 | | |
| 10984 | | > select #4/E:359 |
| 10985 | | |
| 10986 | | 7 atoms, 6 bonds, 1 residue, 1 model selected |
| 10987 | | |
| 10988 | | > select #4/E:357 |
| 10989 | | |
| 10990 | | 11 atoms, 10 bonds, 1 residue, 1 model selected |
| 10991 | | |
| 10992 | | > show sel atoms |
| 10993 | | |
| 10994 | | > select #4/E:354 |
| 10995 | | |
| 10996 | | 9 atoms, 8 bonds, 1 residue, 1 model selected |
| 10997 | | |
| 10998 | | > hide #!3 models |
| 10999 | | |
| 11000 | | > select #4/E:355 |
| 11001 | | |
| 11002 | | 4 atoms, 3 bonds, 1 residue, 1 model selected |
| 11003 | | |
| 11004 | | > select #4/E:354 |
| 11005 | | |
| 11006 | | 9 atoms, 8 bonds, 1 residue, 1 model selected |
| 11007 | | |
| 11008 | | > show #!3 models |
| 11009 | | |
| 11010 | | > hide #!4 models |
| 11011 | | |
| 11012 | | > select #3/E:363 |
| 11013 | | |
| 11014 | | 12 atoms, 12 bonds, 1 residue, 1 model selected |
| 11015 | | |
| 11016 | | > show sel atoms |
| 11017 | | |
| 11018 | | > select #3/E:358 |
| 11019 | | |
| 11020 | | 9 atoms, 8 bonds, 1 residue, 1 model selected |
| 11021 | | |
| 11022 | | > select #3/E:439 |
| 11023 | | |
| 11024 | | 9 atoms, 8 bonds, 1 residue, 1 model selected |
| 11025 | | |
| 11026 | | > show sel atoms |
| 11027 | | |
| 11028 | | > select #3/A:369 |
| 11029 | | |
| 11030 | | 9 atoms, 8 bonds, 1 residue, 1 model selected |
| 11031 | | |
| 11032 | | > show sel atoms |
| 11033 | | |
| 11034 | | > select #3/A:367 |
| 11035 | | |
| 11036 | | 11 atoms, 10 bonds, 1 residue, 1 model selected |
| 11037 | | |
| 11038 | | > show sel atoms |
| 11039 | | |
| 11040 | | > select #3/A:365 |
| 11041 | | |
| 11042 | | 7 atoms, 6 bonds, 1 residue, 1 model selected |
| 11043 | | |
| 11044 | | > show sel atoms |
| 11045 | | |
| 11046 | | > show #!4 models |
| 11047 | | |
| 11048 | | > hide #!3 models |
| 11049 | | |
| 11050 | | > hide #!4 models |
| 11051 | | |
| 11052 | | > show #!3 models |
| 11053 | | |
| 11054 | | > close #3 |
| 11055 | | |
| 11056 | | > close |
| 11057 | | |
| 11058 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11059 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11060 | | > structures/intermediate |
| 11061 | | > results/cryosparc_P370_J407_component_000/J407_component_000_frame_024.mrc" |
| 11062 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11063 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11064 | | > structures/intermediate |
| 11065 | | > results/cryosparc_P370_J407_component_000/J407_component_000_frame_023.mrc" |
| 11066 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11067 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11068 | | > structures/intermediate |
| 11069 | | > results/cryosparc_P370_J407_component_000/J407_component_000_frame_022.mrc" |
| 11070 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11071 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11072 | | > structures/intermediate |
| 11073 | | > results/cryosparc_P370_J407_component_000/J407_component_000_frame_021.mrc" |
| 11074 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11075 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11076 | | > structures/intermediate |
| 11077 | | > results/cryosparc_P370_J407_component_000/J407_component_000_frame_020.mrc" |
| 11078 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11079 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11080 | | > structures/intermediate |
| 11081 | | > results/cryosparc_P370_J407_component_000/J407_component_000_frame_019.mrc" |
| 11082 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11083 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11084 | | > structures/intermediate |
| 11085 | | > results/cryosparc_P370_J407_component_000/J407_component_000_frame_018.mrc" |
| 11086 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11087 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11088 | | > structures/intermediate |
| 11089 | | > results/cryosparc_P370_J407_component_000/J407_component_000_frame_017.mrc" |
| 11090 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11091 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11092 | | > structures/intermediate |
| 11093 | | > results/cryosparc_P370_J407_component_000/J407_component_000_frame_016.mrc" |
| 11094 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11095 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11096 | | > structures/intermediate |
| 11097 | | > results/cryosparc_P370_J407_component_000/J407_component_000_frame_015.mrc" |
| 11098 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11099 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11100 | | > structures/intermediate |
| 11101 | | > results/cryosparc_P370_J407_component_000/J407_component_000_frame_014.mrc" |
| 11102 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11103 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11104 | | > structures/intermediate |
| 11105 | | > results/cryosparc_P370_J407_component_000/J407_component_000_frame_013.mrc" |
| 11106 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11107 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11108 | | > structures/intermediate |
| 11109 | | > results/cryosparc_P370_J407_component_000/J407_component_000_frame_012.mrc" |
| 11110 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11111 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11112 | | > structures/intermediate |
| 11113 | | > results/cryosparc_P370_J407_component_000/J407_component_000_frame_011.mrc" |
| 11114 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11115 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11116 | | > structures/intermediate |
| 11117 | | > results/cryosparc_P370_J407_component_000/J407_component_000_frame_010.mrc" |
| 11118 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11119 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11120 | | > structures/intermediate |
| 11121 | | > results/cryosparc_P370_J407_component_000/J407_component_000_frame_009.mrc" |
| 11122 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11123 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11124 | | > structures/intermediate |
| 11125 | | > results/cryosparc_P370_J407_component_000/J407_component_000_frame_008.mrc" |
| 11126 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11127 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11128 | | > structures/intermediate |
| 11129 | | > results/cryosparc_P370_J407_component_000/J407_component_000_frame_007.mrc" |
| 11130 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11131 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11132 | | > structures/intermediate |
| 11133 | | > results/cryosparc_P370_J407_component_000/J407_component_000_frame_006.mrc" |
| 11134 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11135 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11136 | | > structures/intermediate |
| 11137 | | > results/cryosparc_P370_J407_component_000/J407_component_000_frame_005.mrc" |
| 11138 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11139 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11140 | | > structures/intermediate |
| 11141 | | > results/cryosparc_P370_J407_component_000/J407_component_000_frame_004.mrc" |
| 11142 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11143 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11144 | | > structures/intermediate |
| 11145 | | > results/cryosparc_P370_J407_component_000/J407_component_000_frame_003.mrc" |
| 11146 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11147 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11148 | | > structures/intermediate |
| 11149 | | > results/cryosparc_P370_J407_component_000/J407_component_000_frame_002.mrc" |
| 11150 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11151 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11152 | | > structures/intermediate |
| 11153 | | > results/cryosparc_P370_J407_component_000/J407_component_000_frame_001.mrc" |
| 11154 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11155 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11156 | | > structures/intermediate |
| 11157 | | > results/cryosparc_P370_J407_component_000/J407_component_000_frame_000.mrc" |
| 11158 | | |
| 11159 | | Opened J407_component_000_frame_024.mrc as #1.1, grid size 440,440,440, pixel |
| 11160 | | 0.827, shown at level 0.0246, step 2, values float32 |
| 11161 | | Opened J407_component_000_frame_023.mrc as #1.2, grid size 440,440,440, pixel |
| 11162 | | 0.827, shown at level 0.0247, step 2, values float32 |
| 11163 | | Opened J407_component_000_frame_022.mrc as #1.3, grid size 440,440,440, pixel |
| 11164 | | 0.827, shown at level 0.0246, step 2, values float32 |
| 11165 | | Opened J407_component_000_frame_021.mrc as #1.4, grid size 440,440,440, pixel |
| 11166 | | 0.827, shown at level 0.0248, step 2, values float32 |
| 11167 | | Opened J407_component_000_frame_020.mrc as #1.5, grid size 440,440,440, pixel |
| 11168 | | 0.827, shown at level 0.025, step 2, values float32 |
| 11169 | | Opened J407_component_000_frame_019.mrc as #1.6, grid size 440,440,440, pixel |
| 11170 | | 0.827, shown at level 0.0253, step 2, values float32 |
| 11171 | | Opened J407_component_000_frame_018.mrc as #1.7, grid size 440,440,440, pixel |
| 11172 | | 0.827, shown at level 0.0256, step 2, values float32 |
| 11173 | | Opened J407_component_000_frame_017.mrc as #1.8, grid size 440,440,440, pixel |
| 11174 | | 0.827, shown at level 0.0259, step 2, values float32 |
| 11175 | | Opened J407_component_000_frame_016.mrc as #1.9, grid size 440,440,440, pixel |
| 11176 | | 0.827, shown at level 0.0262, step 2, values float32 |
| 11177 | | Opened J407_component_000_frame_015.mrc as #1.10, grid size 440,440,440, pixel |
| 11178 | | 0.827, shown at level 0.0265, step 2, values float32 |
| 11179 | | Opened J407_component_000_frame_014.mrc as #1.11, grid size 440,440,440, pixel |
| 11180 | | 0.827, shown at level 0.0267, step 2, values float32 |
| 11181 | | Opened J407_component_000_frame_013.mrc as #1.12, grid size 440,440,440, pixel |
| 11182 | | 0.827, shown at level 0.0268, step 2, values float32 |
| 11183 | | Opened J407_component_000_frame_012.mrc as #1.13, grid size 440,440,440, pixel |
| 11184 | | 0.827, shown at level 0.0269, step 2, values float32 |
| 11185 | | Opened J407_component_000_frame_011.mrc as #1.14, grid size 440,440,440, pixel |
| 11186 | | 0.827, shown at level 0.0269, step 2, values float32 |
| 11187 | | Opened J407_component_000_frame_010.mrc as #1.15, grid size 440,440,440, pixel |
| 11188 | | 0.827, shown at level 0.0268, step 2, values float32 |
| 11189 | | Opened J407_component_000_frame_009.mrc as #1.16, grid size 440,440,440, pixel |
| 11190 | | 0.827, shown at level 0.0266, step 2, values float32 |
| 11191 | | Opened J407_component_000_frame_008.mrc as #1.17, grid size 440,440,440, pixel |
| 11192 | | 0.827, shown at level 0.0265, step 2, values float32 |
| 11193 | | Opened J407_component_000_frame_007.mrc as #1.18, grid size 440,440,440, pixel |
| 11194 | | 0.827, shown at level 0.0263, step 2, values float32 |
| 11195 | | Opened J407_component_000_frame_006.mrc as #1.19, grid size 440,440,440, pixel |
| 11196 | | 0.827, shown at level 0.0261, step 2, values float32 |
| 11197 | | Opened J407_component_000_frame_005.mrc as #1.20, grid size 440,440,440, pixel |
| 11198 | | 0.827, shown at level 0.026, step 2, values float32 |
| 11199 | | Opened J407_component_000_frame_004.mrc as #1.21, grid size 440,440,440, pixel |
| 11200 | | 0.827, shown at level 0.0258, step 2, values float32 |
| 11201 | | Opened J407_component_000_frame_003.mrc as #1.22, grid size 440,440,440, pixel |
| 11202 | | 0.827, shown at level 0.0257, step 2, values float32 |
| 11203 | | Opened J407_component_000_frame_002.mrc as #1.23, grid size 440,440,440, pixel |
| 11204 | | 0.827, shown at level 0.0257, step 2, values float32 |
| 11205 | | Opened J407_component_000_frame_001.mrc as #1.24, grid size 440,440,440, pixel |
| 11206 | | 0.827, shown at level 0.0257, step 2, values float32 |
| 11207 | | Opened J407_component_000_frame_000.mrc as #1.25, grid size 440,440,440, pixel |
| 11208 | | 0.827, shown at level 0.0258, step 2, values float32 |
| 11209 | | |
| 11210 | | > volume step 1 |
| 11211 | | |
| 11212 | | > volume level 0.1 |
| 11213 | | |
| 11214 | | > morph #1 |
| 11215 | | |
| 11216 | | Require at least 2 structures for morph |
| 11217 | | |
| 11218 | | > morph #1.1-1.25 |
| 11219 | | |
| 11220 | | Require at least 2 structures for morph |
| 11221 | | |
| 11222 | | > volume morph #1 |
| 11223 | | |
| 11224 | | Opened morph as #2, grid size 440,440,440, pixel 0.827, shown at step 1, |
| 11225 | | values float32 |
| 11226 | | |
| 11227 | | > close #2 |
| 11228 | | |
| 11229 | | > vop flip #1 |
| 11230 | | |
| 11231 | | Opened J407_component_000_frame_024.mrc z flip as #2, grid size 440,440,440, |
| 11232 | | pixel 0.827, shown at step 1, values float32 |
| 11233 | | Opened J407_component_000_frame_023.mrc z flip as #3, grid size 440,440,440, |
| 11234 | | pixel 0.827, shown at step 1, values float32 |
| 11235 | | Opened J407_component_000_frame_022.mrc z flip as #4, grid size 440,440,440, |
| 11236 | | pixel 0.827, shown at step 1, values float32 |
| 11237 | | Opened J407_component_000_frame_021.mrc z flip as #5, grid size 440,440,440, |
| 11238 | | pixel 0.827, shown at step 1, values float32 |
| 11239 | | Opened J407_component_000_frame_020.mrc z flip as #6, grid size 440,440,440, |
| 11240 | | pixel 0.827, shown at step 1, values float32 |
| 11241 | | Opened J407_component_000_frame_019.mrc z flip as #7, grid size 440,440,440, |
| 11242 | | pixel 0.827, shown at step 1, values float32 |
| 11243 | | Opened J407_component_000_frame_018.mrc z flip as #8, grid size 440,440,440, |
| 11244 | | pixel 0.827, shown at step 1, values float32 |
| 11245 | | Opened J407_component_000_frame_017.mrc z flip as #9, grid size 440,440,440, |
| 11246 | | pixel 0.827, shown at step 1, values float32 |
| 11247 | | Opened J407_component_000_frame_016.mrc z flip as #10, grid size 440,440,440, |
| 11248 | | pixel 0.827, shown at step 1, values float32 |
| 11249 | | Opened J407_component_000_frame_015.mrc z flip as #11, grid size 440,440,440, |
| 11250 | | pixel 0.827, shown at step 1, values float32 |
| 11251 | | Opened J407_component_000_frame_014.mrc z flip as #12, grid size 440,440,440, |
| 11252 | | pixel 0.827, shown at step 1, values float32 |
| 11253 | | Opened J407_component_000_frame_013.mrc z flip as #13, grid size 440,440,440, |
| 11254 | | pixel 0.827, shown at step 1, values float32 |
| 11255 | | Opened J407_component_000_frame_012.mrc z flip as #14, grid size 440,440,440, |
| 11256 | | pixel 0.827, shown at step 1, values float32 |
| 11257 | | Opened J407_component_000_frame_011.mrc z flip as #15, grid size 440,440,440, |
| 11258 | | pixel 0.827, shown at step 1, values float32 |
| 11259 | | Opened J407_component_000_frame_010.mrc z flip as #16, grid size 440,440,440, |
| 11260 | | pixel 0.827, shown at step 1, values float32 |
| 11261 | | Opened J407_component_000_frame_009.mrc z flip as #17, grid size 440,440,440, |
| 11262 | | pixel 0.827, shown at step 1, values float32 |
| 11263 | | Opened J407_component_000_frame_008.mrc z flip as #18, grid size 440,440,440, |
| 11264 | | pixel 0.827, shown at step 1, values float32 |
| 11265 | | Opened J407_component_000_frame_007.mrc z flip as #19, grid size 440,440,440, |
| 11266 | | pixel 0.827, shown at step 1, values float32 |
| 11267 | | Opened J407_component_000_frame_006.mrc z flip as #20, grid size 440,440,440, |
| 11268 | | pixel 0.827, shown at step 1, values float32 |
| 11269 | | Opened J407_component_000_frame_005.mrc z flip as #21, grid size 440,440,440, |
| 11270 | | pixel 0.827, shown at step 1, values float32 |
| 11271 | | Opened J407_component_000_frame_004.mrc z flip as #22, grid size 440,440,440, |
| 11272 | | pixel 0.827, shown at step 1, values float32 |
| 11273 | | Opened J407_component_000_frame_003.mrc z flip as #23, grid size 440,440,440, |
| 11274 | | pixel 0.827, shown at step 1, values float32 |
| 11275 | | Opened J407_component_000_frame_002.mrc z flip as #24, grid size 440,440,440, |
| 11276 | | pixel 0.827, shown at step 1, values float32 |
| 11277 | | Opened J407_component_000_frame_001.mrc z flip as #25, grid size 440,440,440, |
| 11278 | | pixel 0.827, shown at step 1, values float32 |
| 11279 | | Opened J407_component_000_frame_000.mrc z flip as #26, grid size 440,440,440, |
| 11280 | | pixel 0.827, shown at step 1, values float32 |
| 11281 | | |
| 11282 | | > close #1 |
| 11283 | | |
| 11284 | | > color #808080 |
| 11285 | | |
| 11286 | | > color grey |
| 11287 | | |
| 11288 | | > color lightgrey |
| 11289 | | |
| 11290 | | > color darkgrey |
| 11291 | | |
| 11292 | | > volume morph #2-26 |
| 11293 | | |
| 11294 | | Opened morph as #1, grid size 440,440,440, pixel 0.827, shown at step 1, |
| 11295 | | values float32 |
| 11296 | | |
| 11297 | | > close #1 |
| 11298 | | |
| 11299 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11300 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11301 | | > structures/intermediate |
| 11302 | | > results/cryosparc_P370_J408_component_000/J408_component_000_frame_024.mrc" |
| 11303 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11304 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11305 | | > structures/intermediate |
| 11306 | | > results/cryosparc_P370_J408_component_000/J408_component_000_frame_023.mrc" |
| 11307 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11308 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11309 | | > structures/intermediate |
| 11310 | | > results/cryosparc_P370_J408_component_000/J408_component_000_frame_022.mrc" |
| 11311 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11312 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11313 | | > structures/intermediate |
| 11314 | | > results/cryosparc_P370_J408_component_000/J408_component_000_frame_021.mrc" |
| 11315 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11316 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11317 | | > structures/intermediate |
| 11318 | | > results/cryosparc_P370_J408_component_000/J408_component_000_frame_020.mrc" |
| 11319 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11320 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11321 | | > structures/intermediate |
| 11322 | | > results/cryosparc_P370_J408_component_000/J408_component_000_frame_019.mrc" |
| 11323 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11324 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11325 | | > structures/intermediate |
| 11326 | | > results/cryosparc_P370_J408_component_000/J408_component_000_frame_018.mrc" |
| 11327 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11328 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11329 | | > structures/intermediate |
| 11330 | | > results/cryosparc_P370_J408_component_000/J408_component_000_frame_017.mrc" |
| 11331 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11332 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11333 | | > structures/intermediate |
| 11334 | | > results/cryosparc_P370_J408_component_000/J408_component_000_frame_016.mrc" |
| 11335 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11336 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11337 | | > structures/intermediate |
| 11338 | | > results/cryosparc_P370_J408_component_000/J408_component_000_frame_015.mrc" |
| 11339 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11340 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11341 | | > structures/intermediate |
| 11342 | | > results/cryosparc_P370_J408_component_000/J408_component_000_frame_014.mrc" |
| 11343 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11344 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11345 | | > structures/intermediate |
| 11346 | | > results/cryosparc_P370_J408_component_000/J408_component_000_frame_013.mrc" |
| 11347 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11348 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11349 | | > structures/intermediate |
| 11350 | | > results/cryosparc_P370_J408_component_000/J408_component_000_frame_012.mrc" |
| 11351 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11352 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11353 | | > structures/intermediate |
| 11354 | | > results/cryosparc_P370_J408_component_000/J408_component_000_frame_011.mrc" |
| 11355 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11356 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11357 | | > structures/intermediate |
| 11358 | | > results/cryosparc_P370_J408_component_000/J408_component_000_frame_010.mrc" |
| 11359 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11360 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11361 | | > structures/intermediate |
| 11362 | | > results/cryosparc_P370_J408_component_000/J408_component_000_frame_009.mrc" |
| 11363 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11364 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11365 | | > structures/intermediate |
| 11366 | | > results/cryosparc_P370_J408_component_000/J408_component_000_frame_008.mrc" |
| 11367 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11368 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11369 | | > structures/intermediate |
| 11370 | | > results/cryosparc_P370_J408_component_000/J408_component_000_frame_007.mrc" |
| 11371 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11372 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11373 | | > structures/intermediate |
| 11374 | | > results/cryosparc_P370_J408_component_000/J408_component_000_frame_006.mrc" |
| 11375 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11376 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11377 | | > structures/intermediate |
| 11378 | | > results/cryosparc_P370_J408_component_000/J408_component_000_frame_005.mrc" |
| 11379 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11380 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11381 | | > structures/intermediate |
| 11382 | | > results/cryosparc_P370_J408_component_000/J408_component_000_frame_004.mrc" |
| 11383 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11384 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11385 | | > structures/intermediate |
| 11386 | | > results/cryosparc_P370_J408_component_000/J408_component_000_frame_003.mrc" |
| 11387 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11388 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11389 | | > structures/intermediate |
| 11390 | | > results/cryosparc_P370_J408_component_000/J408_component_000_frame_002.mrc" |
| 11391 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11392 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11393 | | > structures/intermediate |
| 11394 | | > results/cryosparc_P370_J408_component_000/J408_component_000_frame_001.mrc" |
| 11395 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11396 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11397 | | > structures/intermediate |
| 11398 | | > results/cryosparc_P370_J408_component_000/J408_component_000_frame_000.mrc" |
| 11399 | | |
| 11400 | | Opened J408_component_000_frame_024.mrc as #1.1, grid size 440,440,440, pixel |
| 11401 | | 0.827, shown at level 0.135, step 2, values float32 |
| 11402 | | Opened J408_component_000_frame_023.mrc as #1.2, grid size 440,440,440, pixel |
| 11403 | | 0.827, shown at level 0.112, step 2, values float32 |
| 11404 | | Opened J408_component_000_frame_022.mrc as #1.3, grid size 440,440,440, pixel |
| 11405 | | 0.827, shown at level 0.103, step 2, values float32 |
| 11406 | | Opened J408_component_000_frame_021.mrc as #1.4, grid size 440,440,440, pixel |
| 11407 | | 0.827, shown at level 0.0998, step 2, values float32 |
| 11408 | | Opened J408_component_000_frame_020.mrc as #1.5, grid size 440,440,440, pixel |
| 11409 | | 0.827, shown at level 0.0974, step 2, values float32 |
| 11410 | | Opened J408_component_000_frame_019.mrc as #1.6, grid size 440,440,440, pixel |
| 11411 | | 0.827, shown at level 0.0929, step 2, values float32 |
| 11412 | | Opened J408_component_000_frame_018.mrc as #1.7, grid size 440,440,440, pixel |
| 11413 | | 0.827, shown at level 0.0878, step 2, values float32 |
| 11414 | | Opened J408_component_000_frame_017.mrc as #1.8, grid size 440,440,440, pixel |
| 11415 | | 0.827, shown at level 0.0867, step 2, values float32 |
| 11416 | | Opened J408_component_000_frame_016.mrc as #1.9, grid size 440,440,440, pixel |
| 11417 | | 0.827, shown at level 0.092, step 2, values float32 |
| 11418 | | Opened J408_component_000_frame_015.mrc as #1.10, grid size 440,440,440, pixel |
| 11419 | | 0.827, shown at level 0.105, step 2, values float32 |
| 11420 | | Opened J408_component_000_frame_014.mrc as #1.11, grid size 440,440,440, pixel |
| 11421 | | 0.827, shown at level 0.128, step 2, values float32 |
| 11422 | | Opened J408_component_000_frame_013.mrc as #1.12, grid size 440,440,440, pixel |
| 11423 | | 0.827, shown at level 0.167, step 2, values float32 |
| 11424 | | Opened J408_component_000_frame_012.mrc as #1.13, grid size 440,440,440, pixel |
| 11425 | | 0.827, shown at level 0.216, step 2, values float32 |
| 11426 | | Opened J408_component_000_frame_011.mrc as #1.14, grid size 440,440,440, pixel |
| 11427 | | 0.827, shown at level 0.235, step 2, values float32 |
| 11428 | | Opened J408_component_000_frame_010.mrc as #1.15, grid size 440,440,440, pixel |
| 11429 | | 0.827, shown at level 0.205, step 2, values float32 |
| 11430 | | Opened J408_component_000_frame_009.mrc as #1.16, grid size 440,440,440, pixel |
| 11431 | | 0.827, shown at level 0.166, step 2, values float32 |
| 11432 | | Opened J408_component_000_frame_008.mrc as #1.17, grid size 440,440,440, pixel |
| 11433 | | 0.827, shown at level 0.143, step 2, values float32 |
| 11434 | | Opened J408_component_000_frame_007.mrc as #1.18, grid size 440,440,440, pixel |
| 11435 | | 0.827, shown at level 0.133, step 2, values float32 |
| 11436 | | Opened J408_component_000_frame_006.mrc as #1.19, grid size 440,440,440, pixel |
| 11437 | | 0.827, shown at level 0.128, step 2, values float32 |
| 11438 | | Opened J408_component_000_frame_005.mrc as #1.20, grid size 440,440,440, pixel |
| 11439 | | 0.827, shown at level 0.127, step 2, values float32 |
| 11440 | | Opened J408_component_000_frame_004.mrc as #1.21, grid size 440,440,440, pixel |
| 11441 | | 0.827, shown at level 0.124, step 2, values float32 |
| 11442 | | Opened J408_component_000_frame_003.mrc as #1.22, grid size 440,440,440, pixel |
| 11443 | | 0.827, shown at level 0.123, step 2, values float32 |
| 11444 | | Opened J408_component_000_frame_002.mrc as #1.23, grid size 440,440,440, pixel |
| 11445 | | 0.827, shown at level 0.125, step 2, values float32 |
| 11446 | | Opened J408_component_000_frame_001.mrc as #1.24, grid size 440,440,440, pixel |
| 11447 | | 0.827, shown at level 0.135, step 2, values float32 |
| 11448 | | Opened J408_component_000_frame_000.mrc as #1.25, grid size 440,440,440, pixel |
| 11449 | | 0.827, shown at level 0.154, step 2, values float32 |
| 11450 | | |
| 11451 | | > volume step 1 |
| 11452 | | |
| 11453 | | > volume level 0.1 #1 |
| 11454 | | |
| 11455 | | Expected a keyword |
| 11456 | | |
| 11457 | | > vop level 0.2 #1 |
| 11458 | | |
| 11459 | | > volume level 0.2 #1 |
| 11460 | | |
| 11461 | | Expected a keyword |
| 11462 | | |
| 11463 | | > vop level #1 0.2 |
| 11464 | | |
| 11465 | | > volume level #1 0.2 |
| 11466 | | |
| 11467 | | Invalid "level" argument: Expected a number |
| 11468 | | |
| 11469 | | > vop level |
| 11470 | | |
| 11471 | | > volume level |
| 11472 | | |
| 11473 | | Missing "level" keyword's argument |
| 11474 | | |
| 11475 | | > volume #1.10 level 0.12 |
| 11476 | | |
| 11477 | | > vop #1 level 0.2 |
| 11478 | | |
| 11479 | | > vop #1 level 0.3 |
| 11480 | | |
| 11481 | | > vop #1 level 0.2 |
| 11482 | | |
| 11483 | | > surface dust #1.1 size 8.27 |
| 11484 | | |
| 11485 | | > surface dust #1.2 size 8.27 |
| 11486 | | |
| 11487 | | > surface dust #1.3 size 8.27 |
| 11488 | | |
| 11489 | | > surface dust #1.4 size 8.27 |
| 11490 | | |
| 11491 | | > surface dust #1.5 size 8.27 |
| 11492 | | |
| 11493 | | > surface dust #1.6 size 8.27 |
| 11494 | | |
| 11495 | | > surface dust #1.7 size 8.27 |
| 11496 | | |
| 11497 | | > surface dust #1.8 size 8.27 |
| 11498 | | |
| 11499 | | > surface dust #1.9 size 8.27 |
| 11500 | | |
| 11501 | | > surface dust #1.10 size 8.27 |
| 11502 | | |
| 11503 | | > surface dust #1.11 size 8.27 |
| 11504 | | |
| 11505 | | > surface dust #1.12 size 8.27 |
| 11506 | | |
| 11507 | | > surface dust #1.13 size 8.27 |
| 11508 | | |
| 11509 | | > surface dust #1.14 size 8.27 |
| 11510 | | |
| 11511 | | > surface dust #1.15 size 8.27 |
| 11512 | | |
| 11513 | | > surface dust #1.16 size 8.27 |
| 11514 | | |
| 11515 | | > surface dust #1.17 size 8.27 |
| 11516 | | |
| 11517 | | > surface dust #1.18 size 8.27 |
| 11518 | | |
| 11519 | | > surface dust #1.19 size 8.27 |
| 11520 | | |
| 11521 | | > surface dust #1.20 size 8.27 |
| 11522 | | |
| 11523 | | > surface dust #1.21 size 8.27 |
| 11524 | | |
| 11525 | | > surface dust #1.22 size 8.27 |
| 11526 | | |
| 11527 | | > surface dust #1.23 size 8.27 |
| 11528 | | |
| 11529 | | > surface dust #1.24 size 8.27 |
| 11530 | | |
| 11531 | | > surface dust #1.25 size 8.27 |
| 11532 | | |
| 11533 | | > volume morph #1 |
| 11534 | | |
| 11535 | | Opened morph as #27, grid size 440,440,440, pixel 0.827, shown at step 1, |
| 11536 | | values float32 |
| 11537 | | |
| 11538 | | > surface dust #27 size 8.27 |
| 11539 | | |
| 11540 | | > close #1 |
| 11541 | | |
| 11542 | | > close #27 |
| 11543 | | |
| 11544 | | > volume show |
| 11545 | | |
| 11546 | | > volume hide |
| 11547 | | |
| 11548 | | > volume morph #2-26 |
| 11549 | | |
| 11550 | | Opened morph as #1, grid size 440,440,440, pixel 0.827, shown at step 1, |
| 11551 | | values float32 |
| 11552 | | |
| 11553 | | > hide #!1 models |
| 11554 | | |
| 11555 | | > show #!26 models |
| 11556 | | |
| 11557 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11558 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11559 | | > structures/PDBs/ylODC_54bp- |
| 11560 | | > oriC061_complete/ylODC_54bpOriC061_rev31_PostPhenix.pdb" |
| 11561 | | |
| 11562 | | Chain information for ylODC_54bpOriC061_rev31_PostPhenix.pdb #27 |
| 11563 | | --- |
| 11564 | | Chain | Description |
| 11565 | | A | No description available |
| 11566 | | B | No description available |
| 11567 | | C | No description available |
| 11568 | | D | No description available |
| 11569 | | E | No description available |
| 11570 | | F | No description available |
| 11571 | | G | No description available |
| 11572 | | H | No description available |
| 11573 | | I | No description available |
| 11574 | | |
| 11575 | | |
| 11576 | | > modelfix |
| 11577 | | |
| 11578 | | Changed 25299 atom styles |
| 11579 | | 23699 atoms, 24145 bonds, 9 pseudobonds, 2970 residues, 2 models selected |
| 11580 | | |
| 11581 | | > select /C:220 |
| 11582 | | |
| 11583 | | 11 atoms, 10 bonds, 1 residue, 1 model selected |
| 11584 | | |
| 11585 | | > show #!1 models |
| 11586 | | |
| 11587 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11588 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11589 | | > structures/intermediate results/cryosparc_P370_J380_005_volume_map.mrc" |
| 11590 | | |
| 11591 | | Opened cryosparc_P370_J380_005_volume_map.mrc as #28, grid size 440,440,440, |
| 11592 | | pixel 0.827, shown at level 0.0231, step 2, values float32 |
| 11593 | | |
| 11594 | | > vop flip #28 |
| 11595 | | |
| 11596 | | Opened cryosparc_P370_J380_005_volume_map.mrc z flip as #29, grid size |
| 11597 | | 440,440,440, pixel 0.827, shown at step 1, values float32 |
| 11598 | | |
| 11599 | | > close #28 |
| 11600 | | |
| 11601 | | > volume #29 level 0.09557 |
| 11602 | | |
| 11603 | | > hide #!27 models |
| 11604 | | |
| 11605 | | > select add #27 |
| 11606 | | |
| 11607 | | 25299 atoms, 25927 bonds, 11 pseudobonds, 3050 residues, 3 models selected |
| 11608 | | |
| 11609 | | > select subtract #27 |
| 11610 | | |
| 11611 | | Nothing selected |
| 11612 | | |
| 11613 | | > close #29 |
| 11614 | | |
| 11615 | | > close #27 |
| 11616 | | |
| 11617 | | > show #!1 models |
| 11618 | | |
| 11619 | | > save "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11620 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11621 | | > structures/intermediate results/J407_component0_ORC_OPEN-CLOSE.cxs" |
| 11622 | | |
| 11623 | | > close #1 |
| 11624 | | |
| 11625 | | > close |
| 11626 | | |
| 11627 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11628 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11629 | | > structures/intermediate |
| 11630 | | > results/cryosparc_P370_J407_component_001/J407_component_001_frame_000.mrc" |
| 11631 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11632 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11633 | | > structures/intermediate |
| 11634 | | > results/cryosparc_P370_J407_component_001/J407_component_001_frame_001.mrc" |
| 11635 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11636 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11637 | | > structures/intermediate |
| 11638 | | > results/cryosparc_P370_J407_component_001/J407_component_001_frame_002.mrc" |
| 11639 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11640 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11641 | | > structures/intermediate |
| 11642 | | > results/cryosparc_P370_J407_component_001/J407_component_001_frame_003.mrc" |
| 11643 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11644 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11645 | | > structures/intermediate |
| 11646 | | > results/cryosparc_P370_J407_component_001/J407_component_001_frame_004.mrc" |
| 11647 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11648 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11649 | | > structures/intermediate |
| 11650 | | > results/cryosparc_P370_J407_component_001/J407_component_001_frame_005.mrc" |
| 11651 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11652 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11653 | | > structures/intermediate |
| 11654 | | > results/cryosparc_P370_J407_component_001/J407_component_001_frame_006.mrc" |
| 11655 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11656 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11657 | | > structures/intermediate |
| 11658 | | > results/cryosparc_P370_J407_component_001/J407_component_001_frame_007.mrc" |
| 11659 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11660 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11661 | | > structures/intermediate |
| 11662 | | > results/cryosparc_P370_J407_component_001/J407_component_001_frame_008.mrc" |
| 11663 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11664 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11665 | | > structures/intermediate |
| 11666 | | > results/cryosparc_P370_J407_component_001/J407_component_001_frame_009.mrc" |
| 11667 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11668 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11669 | | > structures/intermediate |
| 11670 | | > results/cryosparc_P370_J407_component_001/J407_component_001_frame_010.mrc" |
| 11671 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11672 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11673 | | > structures/intermediate |
| 11674 | | > results/cryosparc_P370_J407_component_001/J407_component_001_frame_011.mrc" |
| 11675 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11676 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11677 | | > structures/intermediate |
| 11678 | | > results/cryosparc_P370_J407_component_001/J407_component_001_frame_012.mrc" |
| 11679 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11680 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11681 | | > structures/intermediate |
| 11682 | | > results/cryosparc_P370_J407_component_001/J407_component_001_frame_013.mrc" |
| 11683 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11684 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11685 | | > structures/intermediate |
| 11686 | | > results/cryosparc_P370_J407_component_001/J407_component_001_frame_014.mrc" |
| 11687 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11688 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11689 | | > structures/intermediate |
| 11690 | | > results/cryosparc_P370_J407_component_001/J407_component_001_frame_015.mrc" |
| 11691 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11692 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11693 | | > structures/intermediate |
| 11694 | | > results/cryosparc_P370_J407_component_001/J407_component_001_frame_016.mrc" |
| 11695 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11696 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11697 | | > structures/intermediate |
| 11698 | | > results/cryosparc_P370_J407_component_001/J407_component_001_frame_017.mrc" |
| 11699 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11700 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11701 | | > structures/intermediate |
| 11702 | | > results/cryosparc_P370_J407_component_001/J407_component_001_frame_018.mrc" |
| 11703 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11704 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11705 | | > structures/intermediate |
| 11706 | | > results/cryosparc_P370_J407_component_001/J407_component_001_frame_019.mrc" |
| 11707 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11708 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11709 | | > structures/intermediate |
| 11710 | | > results/cryosparc_P370_J407_component_001/J407_component_001_frame_020.mrc" |
| 11711 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11712 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11713 | | > structures/intermediate |
| 11714 | | > results/cryosparc_P370_J407_component_001/J407_component_001_frame_021.mrc" |
| 11715 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11716 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11717 | | > structures/intermediate |
| 11718 | | > results/cryosparc_P370_J407_component_001/J407_component_001_frame_022.mrc" |
| 11719 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11720 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11721 | | > structures/intermediate |
| 11722 | | > results/cryosparc_P370_J407_component_001/J407_component_001_frame_023.mrc" |
| 11723 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11724 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11725 | | > structures/intermediate |
| 11726 | | > results/cryosparc_P370_J407_component_001/J407_component_001_frame_024.mrc" |
| 11727 | | |
| 11728 | | Opened J407_component_001_frame_000.mrc as #1.1, grid size 440,440,440, pixel |
| 11729 | | 0.827, shown at level 0.0267, step 2, values float32 |
| 11730 | | Opened J407_component_001_frame_001.mrc as #1.2, grid size 440,440,440, pixel |
| 11731 | | 0.827, shown at level 0.0266, step 2, values float32 |
| 11732 | | Opened J407_component_001_frame_002.mrc as #1.3, grid size 440,440,440, pixel |
| 11733 | | 0.827, shown at level 0.0265, step 2, values float32 |
| 11734 | | Opened J407_component_001_frame_003.mrc as #1.4, grid size 440,440,440, pixel |
| 11735 | | 0.827, shown at level 0.0264, step 2, values float32 |
| 11736 | | Opened J407_component_001_frame_004.mrc as #1.5, grid size 440,440,440, pixel |
| 11737 | | 0.827, shown at level 0.0264, step 2, values float32 |
| 11738 | | Opened J407_component_001_frame_005.mrc as #1.6, grid size 440,440,440, pixel |
| 11739 | | 0.827, shown at level 0.0263, step 2, values float32 |
| 11740 | | Opened J407_component_001_frame_006.mrc as #1.7, grid size 440,440,440, pixel |
| 11741 | | 0.827, shown at level 0.0264, step 2, values float32 |
| 11742 | | Opened J407_component_001_frame_007.mrc as #1.8, grid size 440,440,440, pixel |
| 11743 | | 0.827, shown at level 0.0264, step 2, values float32 |
| 11744 | | Opened J407_component_001_frame_008.mrc as #1.9, grid size 440,440,440, pixel |
| 11745 | | 0.827, shown at level 0.0264, step 2, values float32 |
| 11746 | | Opened J407_component_001_frame_009.mrc as #1.10, grid size 440,440,440, pixel |
| 11747 | | 0.827, shown at level 0.0265, step 2, values float32 |
| 11748 | | Opened J407_component_001_frame_010.mrc as #1.11, grid size 440,440,440, pixel |
| 11749 | | 0.827, shown at level 0.0266, step 2, values float32 |
| 11750 | | Opened J407_component_001_frame_011.mrc as #1.12, grid size 440,440,440, pixel |
| 11751 | | 0.827, shown at level 0.0266, step 2, values float32 |
| 11752 | | Opened J407_component_001_frame_012.mrc as #1.13, grid size 440,440,440, pixel |
| 11753 | | 0.827, shown at level 0.0267, step 2, values float32 |
| 11754 | | Opened J407_component_001_frame_013.mrc as #1.14, grid size 440,440,440, pixel |
| 11755 | | 0.827, shown at level 0.0268, step 2, values float32 |
| 11756 | | Opened J407_component_001_frame_014.mrc as #1.15, grid size 440,440,440, pixel |
| 11757 | | 0.827, shown at level 0.0269, step 2, values float32 |
| 11758 | | Opened J407_component_001_frame_015.mrc as #1.16, grid size 440,440,440, pixel |
| 11759 | | 0.827, shown at level 0.0269, step 2, values float32 |
| 11760 | | Opened J407_component_001_frame_016.mrc as #1.17, grid size 440,440,440, pixel |
| 11761 | | 0.827, shown at level 0.0269, step 2, values float32 |
| 11762 | | Opened J407_component_001_frame_017.mrc as #1.18, grid size 440,440,440, pixel |
| 11763 | | 0.827, shown at level 0.027, step 2, values float32 |
| 11764 | | Opened J407_component_001_frame_018.mrc as #1.19, grid size 440,440,440, pixel |
| 11765 | | 0.827, shown at level 0.0271, step 2, values float32 |
| 11766 | | Opened J407_component_001_frame_019.mrc as #1.20, grid size 440,440,440, pixel |
| 11767 | | 0.827, shown at level 0.0271, step 2, values float32 |
| 11768 | | Opened J407_component_001_frame_020.mrc as #1.21, grid size 440,440,440, pixel |
| 11769 | | 0.827, shown at level 0.0272, step 2, values float32 |
| 11770 | | Opened J407_component_001_frame_021.mrc as #1.22, grid size 440,440,440, pixel |
| 11771 | | 0.827, shown at level 0.0273, step 2, values float32 |
| 11772 | | Opened J407_component_001_frame_022.mrc as #1.23, grid size 440,440,440, pixel |
| 11773 | | 0.827, shown at level 0.0273, step 2, values float32 |
| 11774 | | Opened J407_component_001_frame_023.mrc as #1.24, grid size 440,440,440, pixel |
| 11775 | | 0.827, shown at level 0.0275, step 2, values float32 |
| 11776 | | Opened J407_component_001_frame_024.mrc as #1.25, grid size 440,440,440, pixel |
| 11777 | | 0.827, shown at level 0.0276, step 2, values float32 |
| 11778 | | |
| 11779 | | > vop flip #1 |
| 11780 | | |
| 11781 | | Opened J407_component_001_frame_000.mrc z flip as #2, grid size 440,440,440, |
| 11782 | | pixel 0.827, shown at step 1, values float32 |
| 11783 | | Opened J407_component_001_frame_001.mrc z flip as #3, grid size 440,440,440, |
| 11784 | | pixel 0.827, shown at step 1, values float32 |
| 11785 | | Opened J407_component_001_frame_002.mrc z flip as #4, grid size 440,440,440, |
| 11786 | | pixel 0.827, shown at step 1, values float32 |
| 11787 | | Opened J407_component_001_frame_003.mrc z flip as #5, grid size 440,440,440, |
| 11788 | | pixel 0.827, shown at step 1, values float32 |
| 11789 | | Opened J407_component_001_frame_004.mrc z flip as #6, grid size 440,440,440, |
| 11790 | | pixel 0.827, shown at step 1, values float32 |
| 11791 | | Opened J407_component_001_frame_005.mrc z flip as #7, grid size 440,440,440, |
| 11792 | | pixel 0.827, shown at step 1, values float32 |
| 11793 | | Opened J407_component_001_frame_006.mrc z flip as #8, grid size 440,440,440, |
| 11794 | | pixel 0.827, shown at step 1, values float32 |
| 11795 | | Opened J407_component_001_frame_007.mrc z flip as #9, grid size 440,440,440, |
| 11796 | | pixel 0.827, shown at step 1, values float32 |
| 11797 | | Opened J407_component_001_frame_008.mrc z flip as #10, grid size 440,440,440, |
| 11798 | | pixel 0.827, shown at step 1, values float32 |
| 11799 | | Opened J407_component_001_frame_009.mrc z flip as #11, grid size 440,440,440, |
| 11800 | | pixel 0.827, shown at step 1, values float32 |
| 11801 | | Opened J407_component_001_frame_010.mrc z flip as #12, grid size 440,440,440, |
| 11802 | | pixel 0.827, shown at step 1, values float32 |
| 11803 | | Opened J407_component_001_frame_011.mrc z flip as #13, grid size 440,440,440, |
| 11804 | | pixel 0.827, shown at step 1, values float32 |
| 11805 | | Opened J407_component_001_frame_012.mrc z flip as #14, grid size 440,440,440, |
| 11806 | | pixel 0.827, shown at step 1, values float32 |
| 11807 | | Opened J407_component_001_frame_013.mrc z flip as #15, grid size 440,440,440, |
| 11808 | | pixel 0.827, shown at step 1, values float32 |
| 11809 | | Opened J407_component_001_frame_014.mrc z flip as #16, grid size 440,440,440, |
| 11810 | | pixel 0.827, shown at step 1, values float32 |
| 11811 | | Opened J407_component_001_frame_015.mrc z flip as #17, grid size 440,440,440, |
| 11812 | | pixel 0.827, shown at step 1, values float32 |
| 11813 | | Opened J407_component_001_frame_016.mrc z flip as #18, grid size 440,440,440, |
| 11814 | | pixel 0.827, shown at step 1, values float32 |
| 11815 | | Opened J407_component_001_frame_017.mrc z flip as #19, grid size 440,440,440, |
| 11816 | | pixel 0.827, shown at step 1, values float32 |
| 11817 | | Opened J407_component_001_frame_018.mrc z flip as #20, grid size 440,440,440, |
| 11818 | | pixel 0.827, shown at step 1, values float32 |
| 11819 | | Opened J407_component_001_frame_019.mrc z flip as #21, grid size 440,440,440, |
| 11820 | | pixel 0.827, shown at step 1, values float32 |
| 11821 | | Opened J407_component_001_frame_020.mrc z flip as #22, grid size 440,440,440, |
| 11822 | | pixel 0.827, shown at step 1, values float32 |
| 11823 | | Opened J407_component_001_frame_021.mrc z flip as #23, grid size 440,440,440, |
| 11824 | | pixel 0.827, shown at step 1, values float32 |
| 11825 | | Opened J407_component_001_frame_022.mrc z flip as #24, grid size 440,440,440, |
| 11826 | | pixel 0.827, shown at step 1, values float32 |
| 11827 | | Opened J407_component_001_frame_023.mrc z flip as #25, grid size 440,440,440, |
| 11828 | | pixel 0.827, shown at step 1, values float32 |
| 11829 | | Opened J407_component_001_frame_024.mrc z flip as #26, grid size 440,440,440, |
| 11830 | | pixel 0.827, shown at step 1, values float32 |
| 11831 | | |
| 11832 | | > vop level 0.1 |
| 11833 | | |
| 11834 | | > hide #!1 models |
| 11835 | | |
| 11836 | | > vop morph #2-26 |
| 11837 | | |
| 11838 | | Opened morph as #27, grid size 440,440,440, pixel 0.827, shown at step 1, |
| 11839 | | values float32 |
| 11840 | | |
| 11841 | | > close |
| 11842 | | |
| 11843 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11844 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11845 | | > structures/intermediate results/cryosparc_P370_J339_component_002.zip" |
| 11846 | | |
| 11847 | | Unrecognized file suffix '.zip' |
| 11848 | | |
| 11849 | | > open "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11850 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11851 | | > structures/intermediate |
| 11852 | | > results/cryosparc_P370_J339_component_002/J339_component_002_frame_000.mrc" |
| 11853 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11854 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11855 | | > structures/intermediate |
| 11856 | | > results/cryosparc_P370_J339_component_002/J339_component_002_frame_001.mrc" |
| 11857 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11858 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11859 | | > structures/intermediate |
| 11860 | | > results/cryosparc_P370_J339_component_002/J339_component_002_frame_002.mrc" |
| 11861 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11862 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11863 | | > structures/intermediate |
| 11864 | | > results/cryosparc_P370_J339_component_002/J339_component_002_frame_003.mrc" |
| 11865 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11866 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11867 | | > structures/intermediate |
| 11868 | | > results/cryosparc_P370_J339_component_002/J339_component_002_frame_004.mrc" |
| 11869 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11870 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11871 | | > structures/intermediate |
| 11872 | | > results/cryosparc_P370_J339_component_002/J339_component_002_frame_005.mrc" |
| 11873 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11874 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11875 | | > structures/intermediate |
| 11876 | | > results/cryosparc_P370_J339_component_002/J339_component_002_frame_006.mrc" |
| 11877 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11878 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11879 | | > structures/intermediate |
| 11880 | | > results/cryosparc_P370_J339_component_002/J339_component_002_frame_007.mrc" |
| 11881 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11882 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11883 | | > structures/intermediate |
| 11884 | | > results/cryosparc_P370_J339_component_002/J339_component_002_frame_008.mrc" |
| 11885 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11886 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11887 | | > structures/intermediate |
| 11888 | | > results/cryosparc_P370_J339_component_002/J339_component_002_frame_009.mrc" |
| 11889 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11890 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11891 | | > structures/intermediate |
| 11892 | | > results/cryosparc_P370_J339_component_002/J339_component_002_frame_010.mrc" |
| 11893 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11894 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11895 | | > structures/intermediate |
| 11896 | | > results/cryosparc_P370_J339_component_002/J339_component_002_frame_011.mrc" |
| 11897 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11898 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11899 | | > structures/intermediate |
| 11900 | | > results/cryosparc_P370_J339_component_002/J339_component_002_frame_012.mrc" |
| 11901 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11902 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11903 | | > structures/intermediate |
| 11904 | | > results/cryosparc_P370_J339_component_002/J339_component_002_frame_013.mrc" |
| 11905 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11906 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11907 | | > structures/intermediate |
| 11908 | | > results/cryosparc_P370_J339_component_002/J339_component_002_frame_014.mrc" |
| 11909 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11910 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11911 | | > structures/intermediate |
| 11912 | | > results/cryosparc_P370_J339_component_002/J339_component_002_frame_015.mrc" |
| 11913 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11914 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11915 | | > structures/intermediate |
| 11916 | | > results/cryosparc_P370_J339_component_002/J339_component_002_frame_016.mrc" |
| 11917 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11918 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11919 | | > structures/intermediate |
| 11920 | | > results/cryosparc_P370_J339_component_002/J339_component_002_frame_017.mrc" |
| 11921 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11922 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11923 | | > structures/intermediate |
| 11924 | | > results/cryosparc_P370_J339_component_002/J339_component_002_frame_018.mrc" |
| 11925 | | > "/Users/jtbauer/Library/CloudStorage/OneDrive- |
| 11926 | | > Personal/Documents/ROTATION_WORK/Joshua-Tor_Lab/need to organize |
| 11927 | | > structures/intermediate |
| 11928 | | > results/cryosparc_P370_J339_component_002/J339_component_002_frame_019.mrc" |
| 11929 | | |
| 11930 | | Opened J339_component_002_frame_000.mrc as #1.1, grid size 440,440,440, pixel |
| 11931 | | 0.827, shown at level 0.0255, step 2, values float32 |
| 11932 | | Opened J339_component_002_frame_001.mrc as #1.2, grid size 440,440,440, pixel |
| 11933 | | 0.827, shown at level 0.0253, step 2, values float32 |
| 11934 | | Opened J339_component_002_frame_002.mrc as #1.3, grid size 440,440,440, pixel |
| 11935 | | 0.827, shown at level 0.0252, step 2, values float32 |
| 11936 | | Opened J339_component_002_frame_003.mrc as #1.4, grid size 440,440,440, pixel |
| 11937 | | 0.827, shown at level 0.025, step 2, values float32 |
| 11938 | | Opened J339_component_002_frame_004.mrc as #1.5, grid size 440,440,440, pixel |
| 11939 | | 0.827, shown at level 0.0248, step 2, values float32 |
| 11940 | | Opened J339_component_002_frame_005.mrc as #1.6, grid size 440,440,440, pixel |
| 11941 | | 0.827, shown at level 0.0248, step 2, values float32 |
| 11942 | | Opened J339_component_002_frame_006.mrc as #1.7, grid size 440,440,440, pixel |
| 11943 | | 0.827, shown at level 0.0247, step 2, values float32 |
| 11944 | | Opened J339_component_002_frame_007.mrc as #1.8, grid size 440,440,440, pixel |
| 11945 | | 0.827, shown at level 0.0246, step 2, values float32 |
| 11946 | | Opened J339_component_002_frame_008.mrc as #1.9, grid size 440,440,440, pixel |
| 11947 | | 0.827, shown at level 0.0247, step 2, values float32 |
| 11948 | | Opened J339_component_002_frame_009.mrc as #1.10, grid size 440,440,440, pixel |
| 11949 | | 0.827, shown at level 0.0247, step 2, values float32 |
| 11950 | | Opened J339_component_002_frame_010.mrc as #1.11, grid size 440,440,440, pixel |
| 11951 | | 0.827, shown at level 0.0248, step 2, values float32 |
| 11952 | | Opened J339_component_002_frame_011.mrc as #1.12, grid size 440,440,440, pixel |
| 11953 | | 0.827, shown at level 0.0249, step 2, values float32 |
| 11954 | | Opened J339_component_002_frame_012.mrc as #1.13, grid size 440,440,440, pixel |
| 11955 | | 0.827, shown at level 0.025, step 2, values float32 |
| 11956 | | Opened J339_component_002_frame_013.mrc as #1.14, grid size 440,440,440, pixel |
| 11957 | | 0.827, shown at level 0.0252, step 2, values float32 |
| 11958 | | Opened J339_component_002_frame_014.mrc as #1.15, grid size 440,440,440, pixel |
| 11959 | | 0.827, shown at level 0.0253, step 2, values float32 |
| 11960 | | Opened J339_component_002_frame_015.mrc as #1.16, grid size 440,440,440, pixel |
| 11961 | | 0.827, shown at level 0.0254, step 2, values float32 |
| 11962 | | Opened J339_component_002_frame_016.mrc as #1.17, grid size 440,440,440, pixel |
| 11963 | | 0.827, shown at level 0.0256, step 2, values float32 |
| 11964 | | Opened J339_component_002_frame_017.mrc as #1.18, grid size 440,440,440, pixel |
| 11965 | | 0.827, shown at level 0.0258, step 2, values float32 |
| 11966 | | Opened J339_component_002_frame_018.mrc as #1.19, grid size 440,440,440, pixel |
| 11967 | | 0.827, shown at level 0.0259, step 2, values float32 |
| 11968 | | Opened J339_component_002_frame_019.mrc as #1.20, grid size 440,440,440, pixel |
| 11969 | | 0.827, shown at level 0.0261, step 2, values float32 |
| 11970 | | |
| 11971 | | > vop flip #1 |
| 11972 | | |
| 11973 | | Opened J339_component_002_frame_000.mrc z flip as #2, grid size 440,440,440, |
| 11974 | | pixel 0.827, shown at step 1, values float32 |
| 11975 | | Opened J339_component_002_frame_001.mrc z flip as #3, grid size 440,440,440, |
| 11976 | | pixel 0.827, shown at step 1, values float32 |
| 11977 | | Opened J339_component_002_frame_002.mrc z flip as #4, grid size 440,440,440, |
| 11978 | | pixel 0.827, shown at step 1, values float32 |
| 11979 | | Opened J339_component_002_frame_003.mrc z flip as #5, grid size 440,440,440, |
| 11980 | | pixel 0.827, shown at step 1, values float32 |
| 11981 | | Opened J339_component_002_frame_004.mrc z flip as #6, grid size 440,440,440, |
| 11982 | | pixel 0.827, shown at step 1, values float32 |
| 11983 | | Opened J339_component_002_frame_005.mrc z flip as #7, grid size 440,440,440, |
| 11984 | | pixel 0.827, shown at step 1, values float32 |
| 11985 | | Opened J339_component_002_frame_006.mrc z flip as #8, grid size 440,440,440, |
| 11986 | | pixel 0.827, shown at step 1, values float32 |
| 11987 | | Opened J339_component_002_frame_007.mrc z flip as #9, grid size 440,440,440, |
| 11988 | | pixel 0.827, shown at step 1, values float32 |
| 11989 | | Opened J339_component_002_frame_008.mrc z flip as #10, grid size 440,440,440, |
| 11990 | | pixel 0.827, shown at step 1, values float32 |
| 11991 | | Opened J339_component_002_frame_009.mrc z flip as #11, grid size 440,440,440, |
| 11992 | | pixel 0.827, shown at step 1, values float32 |
| 11993 | | Opened J339_component_002_frame_010.mrc z flip as #12, grid size 440,440,440, |
| 11994 | | pixel 0.827, shown at step 1, values float32 |
| 11995 | | Opened J339_component_002_frame_011.mrc z flip as #13, grid size 440,440,440, |
| 11996 | | pixel 0.827, shown at step 1, values float32 |
| 11997 | | Opened J339_component_002_frame_012.mrc z flip as #14, grid size 440,440,440, |
| 11998 | | pixel 0.827, shown at step 1, values float32 |
| 11999 | | Opened J339_component_002_frame_013.mrc z flip as #15, grid size 440,440,440, |
| 12000 | | pixel 0.827, shown at step 1, values float32 |
| 12001 | | Opened J339_component_002_frame_014.mrc z flip as #16, grid size 440,440,440, |
| 12002 | | pixel 0.827, shown at step 1, values float32 |
| 12003 | | Opened J339_component_002_frame_015.mrc z flip as #17, grid size 440,440,440, |
| 12004 | | pixel 0.827, shown at step 1, values float32 |
| 12005 | | Opened J339_component_002_frame_016.mrc z flip as #18, grid size 440,440,440, |
| 12006 | | pixel 0.827, shown at step 1, values float32 |
| 12007 | | Opened J339_component_002_frame_017.mrc z flip as #19, grid size 440,440,440, |
| | 3250 | J339_component_002_frame_017.mrc z flip as #19, grid size 440,440,440, |