﻿id	summary	reporter	owner	description	type	status	priority	milestone	component	version	resolution	keywords	cc	blockedby	blocking	notify_on_close	platform	project
4934	Crash computing clashes	macbas@…	Eric Pettersen	"{{{
The following bug report has been submitted:
Platform:        Windows-10-10.0.19041
ChimeraX Version: 1.2.5 (2021-05-24 04:13:57 UTC)
Description
Last time you used ChimeraX it crashed.
Fatal Python error: Aborted

Thread 0x00001eec (most recent call first):
  File ""C:\Program Files\ChimeraX 1.2.5\bin\lib\threading.py"", line 306 in wait
  File ""C:\Program Files\ChimeraX 1.2.5\bin\lib\threading.py"", line 558 in wait
  File ""C:\Program Files\ChimeraX 1.2.5\bin\lib\threading.py"", line 1252 in run
  File ""C:\Program Files\ChimeraX 1.2.5\bin\lib\threading.py"", line 932 in _bootstrap_inner
  File ""C:\Program Files\ChimeraX 1.2.5\bin\lib\threading.py"", line 890 in _bootstrap

Current thread 0x000005c8 (most recent call first):
  File ""C:\Program Files\ChimeraX 1.2.5\bin\lib\site-packages\chimerax\ui\gui.py"", line 293 in event_loop
  File ""C:\Program Files\ChimeraX 1.2.5\bin\lib\site-packages\ChimeraX_main.py"", line 866 in init
  File ""C:\Program Files\ChimeraX 1.2.5\bin\lib\site-packages\ChimeraX_main.py"", line 1015 in 
  File ""C:\Program Files\ChimeraX 1.2.5\bin\lib\runpy.py"", line 87 in _run_code
  File ""C:\Program Files\ChimeraX 1.2.5\bin\lib\runpy.py"", line 194 in _run_module_as_main


Log:
UCSF ChimeraX version: 1.2.5 (2021-05-24)  
© 2016-2021 Regents of the University of California. All rights reserved.  

> open C:\\\Users\\\Maciek\\\Desktop\\\FinO_proteins.cxs

Log from Thu Jul 22 11:19:18 2021UCSF ChimeraX version: 1.2.5 (2021-05-24)  
© 2016-2021 Regents of the University of California. All rights reserved.  

> open C:\\\Users\\\Maciek\\\Desktop\\\FinO_proteins.cxs

Log from Wed Jul 21 14:22:07 2021UCSF ChimeraX version: 1.2.5 (2021-05-24)  
© 2016-2021 Regents of the University of California. All rights reserved.  

> open C:\\\Users\\\Maciek\\\Desktop\\\FinO_proteins.cxs

Log from Tue Jul 20 15:35:07 2021UCSF ChimeraX version: 1.2.5 (2021-05-24)  
© 2016-2021 Regents of the University of California. All rights reserved.  
How to cite UCSF ChimeraX  

> open ""F:/Roboczy_folder/PyMol data/ProQ_czyste.pse""

Unrecognized file suffix '.pse'  

> open
> C:\Users\Maciek\Desktop\Data.copy\\#Studia_doktoranckie_Zakład_Biochemii_zrzut_21.11.19\granty\Preludium\Preludium_2021\robocze_pliki\Structural_alignments\Complete_FopA_strucutre\model1.pdb
> format pdb

Chain information for model1.pdb #1  
---  
Chain | Description  
A | No description available  
  

> ui tool show ""Show Sequence Viewer""

> sequence chain /A

Alignment identifier is 1/A  

> select /A:1

16 atoms, 15 bonds, 1 residue, 1 model selected  

> select /A:1-83

1362 atoms, 1378 bonds, 83 residues, 1 model selected  

> delete :1-83

> open
> F:/Roboczy_folder/Projekt_domeny_FinO/FinO_proteins_strucural_analysis/ProQ.cif

Summary of feedback from opening
F:/Roboczy_folder/Projekt_domeny_FinO/FinO_proteins_strucural_analysis/ProQ.cif  
---  
warnings | Missing entity information. Treating each chain as a separate
entity.  
Atom H is not in the residue template for MET /A:1  
Missing or incomplete entity_poly_seq table. Inferred polymer connectivity.  
  
Chain information for ProQ.cif #2  
---  
Chain | Description  
A | No description available  
  

> set bgColor white

Drag select of 4 residues  
Drag select of 4 residues  

> ui mousemode right ""translate selected models""

> view matrix models #2,1,0,0,12.942,0,1,0,28.822,0,0,1,53.637

> view matrix models #2,1,0,0,6.3703,0,1,0,11.783,0,0,1,23.71

> select clear

> select #1/A:141

14 atoms, 13 bonds, 1 residue, 1 model selected  

> view matrix models #1,1,0,0,-93.527,0,1,0,-56.182,0,0,1,-31.873

Drag select of 8 residues  

> view matrix models #1,1,0,0,-104.36,0,1,0,-51.316,0,0,1,-29.654

> select clear

> select #2/A:39

20 atoms, 20 bonds, 1 residue, 1 model selected  

> view matrix models #2,1,0,0,7.8377,0,1,0,19.276,0,0,1,20.375

> show surfaces

> select clear

> select #2/A:62@CG

1 atom, 1 residue, 1 model selected  

> view matrix models #2,1,0,0,30.309,0,1,0,44.846,0,0,1,0.51203

Drag select of model1.pdb_A SES surface, 470 of 149100 triangles, 3 residues  
Drag select of model1.pdb_A SES surface, 1204 of 149100 triangles, 4 residues  

> view matrix models #1,1,0,0,-84.088,0,1,0,-32.763,0,0,1,-24.099

> view matrix models #1,1,0,0,-84.038,0,1,0,-32.357,0,0,1,-23.877

> select #1/A:110@CG2

1 atom, 1 residue, 1 model selected  

> view matrix models #1,1,0,0,-81.56,0,1,0,-33.393,0,0,1,-25.464

> view matrix models #1,1,0,0,-82.188,0,1,0,-35.326,0,0,1,-26.368

> ui mousemode right rotate

> ui mousemode right ""rotate selected models""

> view matrix models
> #1,0.75178,0.31072,0.58162,-126.55,-0.045219,0.90424,-0.42463,3.4339,-0.65787,0.29293,0.69383,19.179

> select #2/A:36@HB

1 atom, 1 residue, 1 model selected  

> view matrix models
> #2,0.73253,-0.45298,0.50815,29.443,0.23577,0.86909,0.43485,45.548,-0.6386,-0.19873,0.74343,-1.4536

> view matrix models
> #2,0.70446,-0.44583,0.55224,29.368,0.23318,0.88028,0.41321,45.541,-0.67034,-0.16232,0.72408,-1.5369

> ui mousemode right ""translate selected models""

> ui mousemode right ""move picked models""

> view matrix models
> #2,0.70446,-0.44583,0.55224,27.052,0.23318,0.88028,0.41321,43.636,-0.67034,-0.16232,0.72408,0.93157

> view matrix models
> #1,0.75178,0.31072,0.58162,-124.32,-0.045219,0.90424,-0.42463,2.407,-0.65787,0.29293,0.69383,16.982

> select clear

> save C:/Users/Maciek/Desktop/FinO_proteins.cxs

> open 1dvo

1dvo title:  
The X-ray crystal structure of fino, A repressor of bacterial conjugation
[more info...]  
  
Chain information for 1dvo #3  
---  
Chain | Description  
A | fertility inhibition protein O  
  

> show surfaces

> view matrix models #3,1,0,0,-35.537,0,1,0,48.703,0,0,1,33.157

> view matrix models #3,1,0,0,-36.024,0,1,0,44.538,0,0,1,33.904

> tool show ""Show Sequence Viewer""

> sequence chain #3/A

Alignment identifier is 3/A  

> delete #3:33-72

> reneame #1 FopA

Unknown command: reneame #1 FopA  

> rename #1 FopA

> rename #3 FinO

> rename #2 ProQ

> ui mousemode right ""rotate selected models""

> select #1/A:193@CB

1 atom, 1 residue, 1 model selected  

> view matrix models
> #1,0.73395,0.10374,0.67124,-112.7,-0.072924,0.99459,-0.073976,-25.703,-0.67528,0.0053447,0.73754,37.907

> select #3/A:130@CB

1 atom, 1 residue, 1 model selected  

> view matrix models
> #3,0.51046,0.62568,-0.58988,3.4568,0.54159,-0.76676,-0.34462,67.578,-0.66792,-0.14356,-0.73026,149.69

> ui mousemode right ""move picked models""

> view matrix models
> #3,0.51046,0.62568,-0.58988,-5.364,0.54159,-0.76676,-0.34462,81.751,-0.66792,-0.14356,-0.73026,144.86

> view matrix models
> #3,0.51046,0.62568,-0.58988,-18.44,0.54159,-0.76676,-0.34462,63.762,-0.66792,-0.14356,-0.73026,125.94

> select #3/A:128@CG2

1 atom, 1 residue, 1 model selected  

> view matrix models
> #3,0.51046,0.62568,-0.58988,-18.209,0.54159,-0.76676,-0.34462,64.187,-0.66792,-0.14356,-0.73026,125.51

> ui mousemode right ""rotate selected models""

> view matrix models
> #3,0.61278,0.23475,-0.75458,-7.4367,0.75613,-0.45173,0.4735,9.5112,-0.22971,-0.86072,-0.45431,106.47

> ui mousemode right ""move picked models""

> view matrix models
> #3,0.61278,0.23475,-0.75458,-8.2744,0.75613,-0.45173,0.4735,7.5345,-0.22971,-0.86072,-0.45431,108.32

> save C:/Users/Maciek/Desktop/FinO_proteins.cxs

> open 3mw6

3mw6 title:  
Crystal structure of NMB1681 from Neisseria meningitidis MC58, a FinO-like RNA
chaperone [more info...]  
  
Chain information for 3mw6 #4  
---  
Chain | Description  
A B C D E F | uncharacterized protein NMB1681  
  
Non-standard residues in 3mw6 #4  
---  
GOL — glycerol (glycerin; propane-1,2,3-triol)  
  
3mw6 mmCIF Assemblies  
---  
1| software_defined_assembly  
2| software_defined_assembly  
3| software_defined_assembly  
4| software_defined_assembly  
  

> delete #4/B-F

> delete solvent

> style #4 cartoon

Expected a keyword  

> style #4 cartoon atoms

Expected a keyword  

> style #4 atoms cartoon

Expected a keyword  

> usage style

style [objects] [atomStyle] [dashes an integer] [ringFill ringFill]  
— change atom and bond depiction  
objects: an objects specifier or nothing  
atomStyle: one of ball, sphere, or stick or nothing  
ringFill: one of off, on, thick, or thin  

> style #4 cartoon

Expected a keyword  

> style #4

> style #4 ball off

Expected a keyword  

> style #4 sphere FALSE

Expected a keyword  

> style #4 sphere False

Expected a keyword  

> style #4 sphere false

Expected a keyword  

> style #4 sphere off

Expected a keyword  

> hide :4 sphere

Expected a collection of one of 'atoms', 'bonds', 'cartoons', 'models',
'pbonds', 'pseudobonds', 'ribbons', or 'surfaces' or a keyword  

> hide :4 atoms sphere

Expected ',' or a keyword  

> hide :4 spehe atoms

Expected a collection of one of 'atoms', 'bonds', 'cartoons', 'models',
'pbonds', 'pseudobonds', 'ribbons', or 'surfaces' or a keyword  

> style sel sphere

Changed 1 atom style  

> select #4/A:49@N

1 atom, 1 residue, 1 model selected  

> select #4

959 atoms, 975 bonds, 122 residues, 1 model selected  

> style sel sphere

Changed 959 atom styles  

> style sel stick

Changed 959 atom styles  

> style sel stick

Changed 959 atom styles  

> style sel sphere

Changed 959 atom styles  

> style sel ball

Changed 959 atom styles  

> nucleotides sel atoms

> style nucleic & sel stick

Changed 0 atom styles  

> nucleotides sel atoms

> style nucleic & sel stick

Changed 0 atom styles  

> nucleotides sel atoms

> style nucleic & sel stick

Changed 0 atom styles  

> style sel stick

Changed 959 atom styles  

> style sel sphere

Changed 959 atom styles  

> style sel ball

Changed 959 atom styles  

> style sel sphere

Changed 959 atom styles  

> show sel atoms

> show sel atoms

> show sel atoms

> show sel cartoons

> show sel cartoons

> hide sel atoms

> show sel surfaces

> select #4/A:45@O

1 atom, 1 residue, 1 model selected  

> view matrix models #4,1,0,0,-83.513,0,1,0,6.3887,0,0,1,91.272

> view matrix models #4,1,0,0,-62.355,0,1,0,44.93,0,0,1,110.07

> view matrix models #4,1,0,0,-75.954,0,1,0,34.991,0,0,1,133.14

> view matrix models #4,1,0,0,-78.076,0,1,0,34.692,0,0,1,135.32

> view matrix models #4,1,0,0,-77.818,0,1,0,35.594,0,0,1,134.07

> ui mousemode right ""rotate selected models""

> view matrix models
> #4,0.93355,-0.20658,0.29295,-70.557,0.26346,0.94959,-0.16994,34.041,-0.24307,0.23582,0.94091,129.57

> view matrix models
> #4,0.99972,-0.015582,0.018014,-77.327,0.015825,0.99978,-0.013415,35.412,-0.017801,0.013696,0.99975,133.85

> view matrix models
> #4,0.99964,0.017743,-0.019926,-78.37,-0.017438,0.99973,0.015361,35.81,0.020193,-0.015008,0.99968,134.3

> view matrix models
> #4,0.96546,0.18607,-0.18237,-83.237,-0.15651,0.9738,0.16498,38.275,0.20829,-0.13074,0.96929,135.69

> ui mousemode right ""move picked models""

> view matrix models
> #4,0.96546,0.18607,-0.18237,-87.712,-0.15651,0.9738,0.16498,41.86,0.20829,-0.13074,0.96929,135.46

> view matrix models
> #4,0.96546,0.18607,-0.18237,-85.578,-0.15651,0.9738,0.16498,38.781,0.20829,-0.13074,0.96929,137.13

> ui mousemode right ""rotate selected models""

> view matrix models
> #4,0.94083,0.24764,-0.23132,-87.214,-0.197,0.95511,0.22124,39.847,0.27573,-0.16258,0.94739,137.33

> view matrix models
> #4,0.94293,0.24291,-0.22775,-87.091,-0.19407,0.95671,0.2169,39.763,0.27058,-0.16032,0.94925,137.32

> view matrix models
> #4,0.98444,0.12235,-0.1261,-83.807,-0.10904,0.9882,0.10758,37.765,0.13777,-0.092161,0.98617,136.76

> view matrix models
> #4,-0.2608,0.057686,-0.96367,-115.51,0.91335,-0.30856,-0.26566,42.55,-0.31267,-0.94945,0.027786,112.17

> view matrix models
> #4,-0.6873,-0.58226,-0.43427,-104.28,0.49988,0.054608,-0.86437,22.859,0.52701,-0.81116,0.25353,124.93

> view matrix models
> #4,-0.094145,0.14375,-0.98513,-114.79,0.89513,-0.42089,-0.14696,45.672,-0.43576,-0.89565,-0.089048,108

> view matrix models
> #4,-0.25112,0.063529,-0.96587,-115.49,0.91322,-0.31524,-0.25817,42.755,-0.32088,-0.94688,0.021148,111.93

> view matrix models
> #4,-0.648,-0.35412,-0.67431,-110.57,0.72345,-0.0093688,-0.69031,29.39,0.23813,-0.93515,0.26226,122.92

> view matrix models
> #4,0.087728,-0.75589,-0.6488,-101.78,0.81837,-0.31666,0.47958,59.912,-0.56796,-0.57303,0.59082,122.27

> view matrix models
> #4,-0.26659,-0.80893,-0.52398,-101.81,0.89723,-0.40686,0.17162,53.426,-0.35201,-0.42438,0.83426,129.69

> view matrix models
> #4,-0.60755,0.36193,0.70703,-78.933,0.48619,0.87336,-0.029296,40.296,-0.62809,0.32595,-0.70658,86.906

> view matrix models
> #4,-0.64999,0.59008,0.47887,-85.688,0.65851,0.75186,-0.032642,42.221,-0.37931,0.29412,-0.87728,85.135

> view matrix models
> #4,-0.62122,0.60071,0.50323,-84.865,0.6661,0.74305,-0.064716,41.538,-0.4128,0.295,-0.86173,85.204

> view matrix models
> #4,-0.46323,0.64899,0.60352,-81.129,0.68141,0.69624,-0.22568,37.909,-0.56666,0.3067,-0.76474,86.117

> view matrix models
> #4,-0.64319,0.59265,0.48484,-85.489,0.66047,0.74977,-0.040316,42.059,-0.38741,0.29429,-0.87368,85.148

> view matrix models
> #4,-0.63571,0.59544,0.49124,-85.273,0.6625,0.74748,-0.048688,41.881,-0.39619,0.2945,-0.86966,85.165

> view matrix models
> #4,-0.74021,0.55139,0.38478,-88.683,0.62075,0.78032,0.075946,44.428,-0.25837,0.29507,-0.91988,85.204

> view matrix models
> #4,-0.82652,0.50219,0.25432,-92.494,0.55278,0.80943,0.19814,46.687,-0.10635,0.30435,-0.94661,85.918

> view matrix models
> #4,-0.78393,0.52857,0.32567,-90.451,0.59182,0.79474,0.13469,45.547,-0.18763,0.29832,-0.93584,85.453

> view matrix models
> #4,-0.68947,0.57427,0.44141,-86.912,0.64491,0.76414,0.013192,43.173,-0.32973,0.29377,-0.89721,85.106

> view matrix models
> #4,-0.74019,0.55141,0.38481,-88.682,0.62077,0.78031,0.075916,44.428,-0.25841,0.29507,-0.91987,85.204

> view matrix models
> #4,0.52789,0.34594,-0.77567,-104.65,-0.8045,0.49643,-0.32611,22.475,0.27225,0.79617,0.54036,124.03

> view matrix models
> #4,0.069514,0.23518,-0.96946,-113.22,-0.77239,0.62771,0.096889,32.65,0.63133,0.74207,0.22528,119.82

> view matrix models
> #4,-0.66525,0.58415,0.46499,-86.147,0.65372,0.75658,-0.015198,42.587,-0.36068,0.29386,-0.88519,85.114

> view matrix models
> #4,-0.78943,0.52544,0.31736,-90.693,0.58748,0.7966,0.14247,45.691,-0.17795,0.29891,-0.93754,85.499

> view matrix models
> #4,-0.67516,0.58018,0.45558,-86.455,0.6503,0.75967,-0.0036843,42.826,-0.34822,0.29377,-0.89019,85.107

> view matrix models
> #4,-0.031842,0.99322,-0.1118,-95.829,0.97538,0.0553,0.21349,53.566,0.21822,-0.10225,-0.97053,89.729

> ui mousemode right ""move picked models""

> view matrix models
> #4,-0.031842,0.99322,-0.1118,-101.54,0.97538,0.0553,0.21349,59.332,0.21822,-0.10225,-0.97053,88.087

> save C:/Users/Maciek/Desktop/FinO_proteins.cxs

> transparncy 60

Unknown command: transparncy 60  

> transparency 60

> open
> F:/Roboczy_folder/Projekt_domeny_FinO/FinO_proteins_strucural_analysis/chimeraX/4_proteins.aln

Summary of feedback from opening
F:/Roboczy_folder/Projekt_domeny_FinO/FinO_proteins_strucural_analysis/chimeraX/4_proteins.aln  
---  
notes | Alignment identifier is 4_proteins.aln  
Associated FopA chain A to FopA/1-200 with 0 mismatches  
Associated ProQ chain A to Ec_ProQ/1-232 with 0 mismatches  
Associated FinO chain A to Ec_FinO/1-186 with 1 mismatch  
Associated 3mw6 chain A to Nm_ProQ/1-141 with 3 mismatches  
Showing conservation header (""seq_conservation"" residue attribute) for
alignment 4_proteins.aln  
  
Opened 4 sequences from 4_proteins.aln  

> select #3/A:143

11 atoms, 10 bonds, 1 residue, 1 model selected  

> select #3/A:143 #1/A:157 #2/A:80 #4/A:87

70 atoms, 66 bonds, 4 residues, 4 models selected  
Seqview [ID: 4_proteins.aln] region Ec_FinO/1-186..Nm_ProQ/1-141 [161] RMSD:
103.636  
  

> show sel atoms

> color sel blue

> save C:/Users/Maciek/Desktop/FinO_proteins.cxs

> style sel sphere off

Expected a keyword  

> style sel stick

Changed 70 atom styles  

> select clear

> save C:\Users\Maciek\Desktop\image1.png supersample 3

> movie record

> turn y 2 180

> wait 180

> movie encode C:\Users\Maciek\Desktop\movie1.mp4

Movie saved to \C:Users\\...\Desktop\movie1.mp4  
  

> 2dlabels text ""concave side - ProQ R80 and homologous positions""

> view matrix models
> #1,0.73395,0.10374,0.67124,-118.56,-0.072924,0.99459,-0.073976,-27.168,-0.67528,0.0053447,0.73754,44.176

> undo

> ui mousemode right ""move label""

> 2dlabels #5.1 xpos 0.026 ypos 0.905

> save C:/Users/Maciek/Desktop/FinO_proteins.cxs

——— End of log from Tue Jul 20 15:35:07 2021 ———

opened ChimeraX session  

> ui tool show Rotamers

> select #3/A:151@CA

1 atom, 1 residue, 1 model selected  

> select #3/A:151@CA

1 atom, 1 residue, 1 model selected  

> select #3/A:144@CE1

1 atom, 1 residue, 1 model selected  

> select #3/A:95@CB

1 atom, 1 residue, 1 model selected  

> select #3/A:144@CE1

1 atom, 1 residue, 1 model selected  

> select #3/A:95@CD1

1 atom, 1 residue, 1 model selected  

> select #3/A:144@CE1

1 atom, 1 residue, 1 model selected  

> select #3/A:143

11 atoms, 10 bonds, 1 residue, 1 model selected  

> select #3/A:143 #1/A:157 #2/A:80 #4/A:87

70 atoms, 66 bonds, 4 residues, 4 models selected  
Seqview [ID: 4_proteins.aln] region Ec_FinO/1-186..Nm_ProQ/1-141 [161] RMSD:
103.636  
  

> style sel sticks

Expected a keyword  

> hide sel atoms

> show sel atoms

> style sel stick

Changed 70 atom styles  

> style sel stick

Changed 70 atom styles  

> style sel ringFill off

Changed 4 residue ring styles  

> select clear

> select #3/A:143

11 atoms, 10 bonds, 1 residue, 1 model selected  

> select #3/A:143 #1/A:157 #2/A:80 #4/A:87

70 atoms, 66 bonds, 4 residues, 4 models selected  
Seqview [ID: 4_proteins.aln] region Ec_FinO/1-186..Nm_ProQ/1-141 [161] RMSD:
103.636  
  

> style sel ball

Changed 70 atom styles  

> style sel ball

Changed 70 atom styles  

> style sel sphere

Changed 70 atom styles  

> style sel sphere

Changed 70 atom styles  

> style sel stick

Changed 70 atom styles  

> hide sel @H

Expected a collection of one of 'atoms', 'bonds', 'cartoons', 'models',
'pbonds', 'pseudobonds', 'ribbons', or 'surfaces' or a keyword  

> hide sel @hydrogens

Expected a collection of one of 'atoms', 'bonds', 'cartoons', 'models',
'pbonds', 'pseudobonds', 'ribbons', or 'surfaces' or a keyword  

> hide sel @hydrogens atoms

Expected a collection of one of 'atoms', 'bonds', 'cartoons', 'models',
'pbonds', 'pseudobonds', 'ribbons', or 'surfaces' or a keyword  

> hide hydrogen

Expected a collection of one of 'atoms', 'bonds', 'cartoons', 'models',
'pbonds', 'pseudobonds', 'ribbons', or 'surfaces' or a keyword  

> hide hydrogen atoms

Expected a collection of one of 'atoms', 'bonds', 'cartoons', 'models',
'pbonds', 'pseudobonds', 'ribbons', or 'surfaces' or a keyword  

> hide @hydrogen atoms

> hide atoms @hydrogen

Expected ',' or a keyword  

> hide atoms hydro

Expected ',' or a keyword  

> delete H

> save C:/Users/Maciek/Desktop/FinO_proteins.cxs

——— End of log from Wed Jul 21 14:22:07 2021 ———

opened ChimeraX session  

> delete 2dlabels

Missing or invalid ""atoms"" argument: invalid atoms specifier  

> 2dlabels delete

> mmaker #1 #2 #3 to #4

Parameters  
---  
Chain pairing | bb  
Alignment algorithm | Needleman-Wunsch  
Similarity matrix | BLOSUM-62  
SS fraction | 0.3  
Gap open (HH/SS/other) | 18/18/6  
Gap extend | 1  
SS matrix |  |  | H | S | O  
---|---|---|---  
H | 6 | -9 | -6  
S |  | 6 | -6  
O |  |  | 4  
Iteration cutoff | 2  
  
Matchmaker 3mw6, chain A (#4) with FopA, chain A (#1), sequence alignment
score = 139.1  
RMSD between 47 pruned atom pairs is 1.091 angstroms; (across all 101 pairs:
7.497)  
  
Matchmaker 3mw6, chain A (#4) with ProQ, chain A (#2), sequence alignment
score = 70.4  
RMSD between 34 pruned atom pairs is 1.090 angstroms; (across all 101 pairs:
7.560)  
  
Matchmaker 3mw6, chain A (#4) with FinO, chain A (#3), sequence alignment
score = 106.7  
RMSD between 56 pruned atom pairs is 1.012 angstroms; (across all 97 pairs:
8.039)  
  

> select clear

> hide surfaces

> hide cartoons

> undo

> hide cartoons

> select #3/A:143 #1/A:157 #2/A:80 #4/A:87

44 atoms, 40 bonds, 4 residues, 4 models selected  

> select #2/A:80

11 atoms, 10 bonds, 1 residue, 1 model selected  

> select #2/A:80

11 atoms, 10 bonds, 1 residue, 1 model selected  

> hide śel

Expected a collection of one of 'atoms', 'bonds', 'cartoons', 'models',
'pbonds', 'pseudobonds', 'ribbons', or 'surfaces' or a keyword  

> hide ~sel

> save C:/Users/Maciek/Desktop/FinO_proteins.cxs

——— End of log from Thu Jul 22 11:19:18 2021 ———

opened ChimeraX session  




OpenGL version: 3.3.0 - Build 27.20.100.8935
OpenGL renderer: Intel(R) UHD Graphics 630
OpenGL vendor: Intel
Manufacturer: Dell Inc.
Model: OptiPlex 7070
OS: Microsoft Windows 10 Pro (Build 19042)
Memory: 8,361,283,584
MaxProcessMemory: 137,438,953,344
CPU: 6 Intel(R) Core(TM) i5-9500 CPU @ 3.00GHz
OSLanguage: pl-PL
Locale: ('pl_PL', 'cp1250')
PyQt5 5.15.2, Qt 5.15.2
Installed Packages:
    alabaster: 0.7.12
    appdirs: 1.4.4
    Babel: 2.9.1
    backcall: 0.2.0
    blockdiag: 2.0.1
    certifi: 2020.12.5
    cftime: 1.5.0
    chardet: 3.0.4
    ChimeraX-AddCharge: 1.0.1
    ChimeraX-AddH: 2.1.6
    ChimeraX-AlignmentAlgorithms: 2.0
    ChimeraX-AlignmentHdrs: 3.2
    ChimeraX-AlignmentMatrices: 2.0
    ChimeraX-Alignments: 2.1
    ChimeraX-AmberInfo: 1.0
    ChimeraX-Arrays: 1.0
    ChimeraX-Atomic: 1.13.2
    ChimeraX-AtomicLibrary: 3.1.3
    ChimeraX-AtomSearch: 2.0
    ChimeraX-AtomSearchLibrary: 1.0
    ChimeraX-AxesPlanes: 2.0
    ChimeraX-BasicActions: 1.1
    ChimeraX-BILD: 1.0
    ChimeraX-BlastProtein: 1.1
    ChimeraX-BondRot: 2.0
    ChimeraX-BugReporter: 1.0
    ChimeraX-BuildStructure: 2.5.2
    ChimeraX-Bumps: 1.0
    ChimeraX-BundleBuilder: 1.1
    ChimeraX-ButtonPanel: 1.0
    ChimeraX-CageBuilder: 1.0
    ChimeraX-CellPack: 1.0
    ChimeraX-Centroids: 1.1
    ChimeraX-ChemGroup: 2.0
    ChimeraX-Clashes: 2.1
    ChimeraX-ColorActions: 1.0
    ChimeraX-ColorGlobe: 1.0
    ChimeraX-ColorKey: 1.2.1
    ChimeraX-CommandLine: 1.1.4
    ChimeraX-ConnectStructure: 2.0
    ChimeraX-Contacts: 1.0
    ChimeraX-Core: 1.2.5
    ChimeraX-CoreFormats: 1.0
    ChimeraX-coulombic: 1.1.1
    ChimeraX-Crosslinks: 1.0
    ChimeraX-Crystal: 1.0
    ChimeraX-CrystalContacts: 1.0
    ChimeraX-DataFormats: 1.1
    ChimeraX-Dicom: 1.0
    ChimeraX-DistMonitor: 1.1.3
    ChimeraX-DistUI: 1.0
    ChimeraX-Dssp: 2.0
    ChimeraX-EMDB-SFF: 1.0
    ChimeraX-ExperimentalCommands: 1.0
    ChimeraX-FileHistory: 1.0
    ChimeraX-FunctionKey: 1.0
    ChimeraX-Geometry: 1.1
    ChimeraX-gltf: 1.0
    ChimeraX-Graphics: 1.0
    ChimeraX-Hbonds: 2.1
    ChimeraX-Help: 1.1
    ChimeraX-HKCage: 1.3
    ChimeraX-IHM: 1.0
    ChimeraX-ImageFormats: 1.1
    ChimeraX-IMOD: 1.0
    ChimeraX-IO: 1.0.1
    ChimeraX-Label: 1.0
    ChimeraX-ListInfo: 1.1.1
    ChimeraX-Log: 1.1.2
    ChimeraX-LookingGlass: 1.1
    ChimeraX-Maestro: 1.8.1
    ChimeraX-Map: 1.0.2
    ChimeraX-MapData: 2.0
    ChimeraX-MapEraser: 1.0
    ChimeraX-MapFilter: 2.0
    ChimeraX-MapFit: 2.0
    ChimeraX-MapSeries: 2.0
    ChimeraX-Markers: 1.0
    ChimeraX-Mask: 1.0
    ChimeraX-MatchMaker: 1.2.1
    ChimeraX-MDcrds: 2.2
    ChimeraX-MedicalToolbar: 1.0.1
    ChimeraX-Meeting: 1.0
    ChimeraX-MLP: 1.1
    ChimeraX-mmCIF: 2.3
    ChimeraX-MMTF: 2.1
    ChimeraX-Modeller: 1.0.1
    ChimeraX-ModelPanel: 1.0.1
    ChimeraX-ModelSeries: 1.0
    ChimeraX-Mol2: 2.0
    ChimeraX-Morph: 1.0
    ChimeraX-MouseModes: 1.1
    ChimeraX-Movie: 1.0
    ChimeraX-Neuron: 1.0
    ChimeraX-Nucleotides: 2.0.1
    ChimeraX-OpenCommand: 1.5
    ChimeraX-PDB: 2.4.1
    ChimeraX-PDBBio: 1.0
    ChimeraX-PDBLibrary: 1.0.1
    ChimeraX-PDBMatrices: 1.0
    ChimeraX-PickBlobs: 1.0
    ChimeraX-Positions: 1.0
    ChimeraX-PresetMgr: 1.0.1
    ChimeraX-PubChem: 2.0.1
    ChimeraX-ReadPbonds: 1.0
    ChimeraX-Registration: 1.1
    ChimeraX-RemoteControl: 1.0
    ChimeraX-ResidueFit: 1.0
    ChimeraX-RestServer: 1.1
    ChimeraX-RNALayout: 1.0
    ChimeraX-RotamerLibMgr: 2.0
    ChimeraX-RotamerLibsDunbrack: 2.0
    ChimeraX-RotamerLibsDynameomics: 2.0
    ChimeraX-RotamerLibsRichardson: 2.0
    ChimeraX-SaveCommand: 1.4
    ChimeraX-SchemeMgr: 1.0
    ChimeraX-SDF: 2.0
    ChimeraX-Segger: 1.0
    ChimeraX-Segment: 1.0
    ChimeraX-SeqView: 2.3
    ChimeraX-Shape: 1.0.1
    ChimeraX-Shell: 1.0
    ChimeraX-Shortcuts: 1.0
    ChimeraX-ShowAttr: 1.0
    ChimeraX-ShowSequences: 1.0
    ChimeraX-SideView: 1.0
    ChimeraX-Smiles: 2.0.1
    ChimeraX-SmoothLines: 1.0
    ChimeraX-SpaceNavigator: 1.0
    ChimeraX-StdCommands: 1.3.1
    ChimeraX-STL: 1.0
    ChimeraX-Storm: 1.0
    ChimeraX-Struts: 1.0
    ChimeraX-Surface: 1.0
    ChimeraX-SwapAA: 2.0
    ChimeraX-SwapRes: 2.1
    ChimeraX-TapeMeasure: 1.0
    ChimeraX-Test: 1.0
    ChimeraX-Toolbar: 1.0.1
    ChimeraX-ToolshedUtils: 1.2
    ChimeraX-Tug: 1.0
    ChimeraX-UI: 1.7.6
    ChimeraX-uniprot: 2.1
    ChimeraX-UnitCell: 1.0
    ChimeraX-ViewDockX: 1.0
    ChimeraX-Vive: 1.1
    ChimeraX-VolumeMenu: 1.0
    ChimeraX-VTK: 1.0
    ChimeraX-WavefrontOBJ: 1.0
    ChimeraX-WebCam: 1.0
    ChimeraX-WebServices: 1.0
    ChimeraX-Zone: 1.0
    colorama: 0.4.3
    comtypes: 1.1.7
    cxservices: 1.0
    cycler: 0.10.0
    Cython: 0.29.21
    decorator: 5.0.9
    distlib: 0.3.1
    docutils: 0.16
    filelock: 3.0.12
    funcparserlib: 0.3.6
    grako: 3.16.5
    h5py: 2.10.0
    html2text: 2020.1.16
    idna: 2.10
    ihm: 0.17
    imagecodecs: 2020.5.30
    imagesize: 1.2.0
    ipykernel: 5.3.4
    ipython: 7.18.1
    ipython-genutils: 0.2.0
    jedi: 0.17.2
    Jinja2: 2.11.2
    jupyter-client: 6.1.7
    jupyter-core: 4.7.1
    kiwisolver: 1.3.1
    line-profiler: 2.1.2
    lxml: 4.6.2
    lz4: 3.1.0
    MarkupSafe: 2.0.1
    matplotlib: 3.3.2
    msgpack: 1.0.0
    netCDF4: 1.5.4
    networkx: 2.5
    numexpr: 2.7.3
    numpy: 1.19.2
    numpydoc: 1.1.0
    openvr: 1.14.1501
    packaging: 20.9
    ParmEd: 3.2.0
    parso: 0.7.1
    pickleshare: 0.7.5
    Pillow: 7.2.0
    pip: 21.0.1
    pkginfo: 1.5.0.1
    prompt-toolkit: 3.0.18
    psutil: 5.7.2
    pycollada: 0.7.1
    pydicom: 2.0.0
    Pygments: 2.7.1
    PyOpenGL: 3.1.5
    PyOpenGL-accelerate: 3.1.5
    pyparsing: 2.4.7
    PyQt5-commercial: 5.15.2
    PyQt5-sip: 12.8.1
    PyQtWebEngine-commercial: 5.15.2
    python-dateutil: 2.8.1
    pytz: 2021.1
    pywin32: 228
    pyzmq: 22.0.3
    qtconsole: 4.7.7
    QtPy: 1.9.0
    RandomWords: 0.3.0
    requests: 2.24.0
    scipy: 1.5.2
    setuptools: 50.3.2
    sfftk-rw: 0.6.7.dev1
    six: 1.15.0
    snowballstemmer: 2.1.0
    sortedcontainers: 2.2.2
    Sphinx: 3.2.1
    sphinxcontrib-applehelp: 1.0.2
    sphinxcontrib-blockdiag: 2.0.0
    sphinxcontrib-devhelp: 1.0.2
    sphinxcontrib-htmlhelp: 2.0.0
    sphinxcontrib-jsmath: 1.0.1
    sphinxcontrib-qthelp: 1.0.3
    sphinxcontrib-serializinghtml: 1.1.5
    suds-jurko: 0.6
    tables: 3.6.1
    tifffile: 2020.9.3
    tinyarray: 1.2.3
    tornado: 6.1
    traitlets: 5.0.5
    urllib3: 1.25.11
    wcwidth: 0.2.5
    webcolors: 1.11.1
    wheel: 0.36.0
    wheel-filename: 1.3.0
    WMI: 1.5.1

}}}
"	defect	closed	normal		Structure Analysis		can't reproduce		Tom Goddard				all	ChimeraX
