Opened 17 months ago
Closed 17 months ago
#15244 closed defect (can't reproduce)
Crash giving widget focus
Reported by: | Owned by: | Tom Goddard | |
---|---|---|---|
Priority: | normal | Milestone: | |
Component: | Window Toolkit | Version: | |
Keywords: | Cc: | Eric Pettersen | |
Blocked By: | Blocking: | ||
Notify when closed: | Platform: | all | |
Project: | ChimeraX |
Description
The following bug report has been submitted: Platform: macOS-10.16-x86_64-i386-64bit ChimeraX Version: 1.6.1 (2023-05-09 17:57:07 UTC) Description Last time you used ChimeraX it crashed. Please describe steps that led to the crash here. {"app_name":"ChimeraX","timestamp":"2024-05-17 21:42:40.00 -0700","app_version":"1.6.1","slice_uuid":"5df621ee-554e-36a8-b448-93b2334e5480","build_version":"1.6.1.0","platform":1,"bundleID":"edu.ucsf.cgl.ChimeraX","share_with_app_devs":1,"is_first_party":0,"bug_type":"309","os_version":"macOS 13.6.6 (22G630)","roots_installed":0,"name":"ChimeraX","incident_id":"EF96BC6C-99FA-49FF-BA2B-936F7D97B11E"} { "uptime" : 14000, "procRole" : "Foreground", "version" : 2, "userID" : 502, "deployVersion" : 210, "modelCode" : "MacBookPro14,1", "coalitionID" : 1444, "osVersion" : { "train" : "macOS 13.6.6", "build" : "22G630", "releaseType" : "User" }, "captureTime" : "2024-05-17 21:42:19.7346 -0700", "incident" : "EF96BC6C-99FA-49FF-BA2B-936F7D97B11E", "pid" : 7187, "cpuType" : "X86-64", "roots_installed" : 0, "bug_type" : "309", "procLaunch" : "2024-05-17 21:39:18.4071 -0700", "procStartAbsTime" : 14691723790889, "procExitAbsTime" : 14872980099145, "procName" : "ChimeraX", "procPath" : "\/Applications\/ChimeraX-1.6.1.app\/Contents\/MacOS\/ChimeraX", "bundleInfo" : {"CFBundleShortVersionString":"1.6.1","CFBundleVersion":"1.6.1.0","CFBundleIdentifier":"edu.ucsf.cgl.ChimeraX"}, "storeInfo" : {"deviceIdentifierForVendor":"840A055B-A76B-563D-B314-53AF546F5152","thirdParty":true}, "parentProc" : "launchd", "parentPid" : 1, "coalitionName" : "edu.ucsf.cgl.ChimeraX", "crashReporterKey" : "7696617D-CAD3-F661-560A-9FD813E482F7", "codeSigningID" : "edu.ucsf.cgl.ChimeraX", "codeSigningTeamID" : "LWV8X224YF", "codeSigningFlags" : 570491649, "codeSigningValidationCategory" : 6, "codeSigningTrustLevel" : 0, "wakeTime" : 594, "sleepWakeUUID" : "8AF9EA36-24F5-4DB2-AE9E-8BD4619791EC", "sip" : "enabled", "vmRegionInfo" : "0x40 is not in any region. 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"threadTriggered" : { "name" : "CrBrowserMain", "queue" : "com.apple.main-thread" } }, "logWritingSignature" : "47612cd3244d6da5535561d52c576a7d6508b1e9", "trialInfo" : { "rollouts" : [ { "rolloutId" : "6410af69ed1e1e7ab93ed169", "factorPackIds" : { }, "deploymentId" : 240000011 }, { "rolloutId" : "60da5e84ab0ca017dace9abf", "factorPackIds" : { }, "deploymentId" : 240000008 } ], "experiments" : [ ] } } Log: UCSF ChimeraX version: 1.6.1 (2023-05-09) © 2016-2023 Regents of the University of California. All rights reserved. > open /Users/biq2001/Documents/Work/Cys-story-figures-scrach/figure-2/all- > ligand-color-map.cxs Opened cryosparc_P61_J150_008_volume_map_sharp.mrc as #1, grid size 300,300,300, pixel 0.825, shown at level 0.62, step 1, values float32 Opened cryosparc_P59_J39_008_volume_map_sharp.mrc as #3, grid size 256,256,256, pixel 1.08, shown at level 0.614, step 1, values float32 Opened cryosparc_P100_J155_008_volume_map_sharp.mrc as #5, grid size 240,240,240, pixel 1.16, shown at level 0.614, step 1, values float32 Opened cryosparc_P113_J33_009_volume_map_sharp.mrc as #7, grid size 320,320,320, pixel 0.844, shown at level 0.34, step 1, values float32 Log from Fri May 17 17:01:07 2024UCSF ChimeraX version: 1.6.1 (2023-05-09) © 2016-2023 Regents of the University of California. All rights reserved. > open /Users/biq2001/Documents/Work/Cys-story-figures-scrach/figure-2/all- > ligand-color-map.cxs Opened cryosparc_P61_J150_008_volume_map_sharp.mrc as #1, grid size 300,300,300, pixel 0.825, shown at level 0.62, step 1, values float32 Opened cryosparc_P59_J39_008_volume_map_sharp.mrc as #3, grid size 256,256,256, pixel 1.08, shown at level 0.614, step 1, values float32 Opened cryosparc_P100_J155_008_volume_map_sharp.mrc as #5, grid size 240,240,240, pixel 1.16, shown at level 0.614, step 1, values float32 Opened cryosparc_P113_J33_009_volume_map_sharp.mrc as #7, grid size 320,320,320, pixel 0.844, shown at level 0.34, step 1, values float32 Log from Fri May 17 16:45:44 2024UCSF ChimeraX version: 1.6.1 (2023-05-09) © 2016-2023 Regents of the University of California. All rights reserved. > open /Users/biq2001/Documents/Work/Cys-story-figures-scrach/figure-2/all- > ligand-color-map.cxs Opened cryosparc_P61_J150_008_volume_map_sharp.mrc as #1, grid size 300,300,300, pixel 0.825, shown at level 0.62, step 1, values float32 Opened cryosparc_P59_J39_008_volume_map_sharp.mrc as #3, grid size 256,256,256, pixel 1.08, shown at level 0.614, step 1, values float32 Log from Thu May 16 16:26:30 2024UCSF ChimeraX version: 1.6.1 (2023-05-09) © 2016-2023 Regents of the University of California. All rights reserved. > open /Users/biq2001/Documents/Work/Cys-story-figures-scrach/figure-2/Cys- > timer-color-map.cxs Opened cryosparc_P61_J150_008_volume_map_sharp.mrc as #1, grid size 300,300,300, pixel 0.825, shown at level 0.62, step 1, values float32 Log from Wed May 15 11:30:14 2024 Startup Messages --- warning | Replacing fetcher for 'pdb_nmr' and format NMRSTAR from NMRSTAR bundle with that from NMRSTAR bundle UCSF ChimeraX version: 1.6.1 (2023-05-09) © 2016-2023 Regents of the University of California. All rights reserved. How to cite UCSF ChimeraX > open /Users/biq2001/Dropbox/Biao's_folder/Cys-and-D-Asp/Cys- > Trimer/cryosparc_P61_J150_008_volume_map_sharp.mrc Opened cryosparc_P61_J150_008_volume_map_sharp.mrc as #1, grid size 300,300,300, pixel 0.825, shown at level 0.285, step 2, values float32 > hide #!1 models > show #!1 models > volume #1 step 1 > volume #1 level 0.6637 > set bgColor white > open /Users/biq2001/Dropbox/Biao's_folder/Cys-and-D-Asp/Cys- > Trimer/iOFS*-GlufitJ150.pdb Chain information for iOFS*-GlufitJ150.pdb #2 --- Chain | Description A B C | No description available > volume #1 level 0.7497 > view orient > turn x 90 > view orient > turn x 90 > hide atoms > view name Cys-trimer-side > color #2:13-83, 125-275 wheat > hide #!1 models > show #!1 models > ui tool show "Color Zone" > color zone #1 near #2 distance 4.95 > hide #!2 models > show #!2 models > color single #1 > color zone #1 near #2 distance 4.95 [Repeated 1 time(s)] > color single #1 > color #2: 84-124, 276-500 skyblue > color zone #1 near #2 distance 4.95 > hide #!1 models > show #!1 models > hide #!1 models > show #!1 models > hide cartoons [Repeated 1 time(s)] > select #2:13-500 9255 atoms, 9393 bonds, 6 pseudobonds, 1218 residues, 2 models selected > color zone #1 near sel distance 4.95 > hide #!1 models > show #!1 models > color zone #1 near sel distance 1 > color zone #1 near sel distance 1.5 [Repeated 3 time(s)] > color zone #1 near sel distance 1 [Repeated 1 time(s)] > color zone #1 near sel distance 1.5 [Repeated 1 time(s)] > color zone #1 near sel distance 2 [Repeated 1 time(s)] > volume #1 level 0.6 > surface dust #1 size 8.25 > color zone #1 near sel distance 2.5 [Repeated 1 time(s)] > hide #!1 models > show #!1 models > hide #!1 models > hide #!2 models > show #!2 models > show sel atoms > style sel sphere Changed 9255 atom styles > show #!1 models > color zone #1 near sel distance 2 > color zone #1 near sel distance 3 [Repeated 1 time(s)] > color zone #1 near sel distance 5 [Repeated 1 time(s)] > hide #!2 models > show #!2 models > hide #!1 models > style sel stick Changed 9255 atom styles > style sel ball Changed 9255 atom styles > show #!1 models > style sel sphere Changed 9255 atom styles > style sel stick Changed 9255 atom styles > volume #1 color #b2b2b282 > ui windowfill toggle [Repeated 1 time(s)] > select clear > volume #1 color #b2b2b2 No atoms selected for color zoning > select #2:13-500 9255 atoms, 9393 bonds, 6 pseudobonds, 1218 residues, 2 models selected > color zone #1 near sel distance 5 > color zone #1 near sel distance 2 [Repeated 1 time(s)] > color zone #1 near sel distance 2.5 [Repeated 2 time(s)] > view list Named views: Cys-trimer-side > view list Named views: Cys-trimer-side > ui windowfill toggle [Repeated 1 time(s)] > ui tool show Log > view Cys-trimer-side > hide #!2 models > view Cys-trimer-side > turn y 45 > turn y -45 > turn y 5 [Repeated 9 time(s)] > volume #1 level 0.62 > view name cys-trimer-side-view2 > color #2: 84-124, 276-500 #1F78B4 > color zone #1 near sel distance 2.5 > color zone #1 near sel distance 2 > color zone #1 near sel distance 3 [Repeated 1 time(s)] > color zone #1 near sel distance 3.5 [Repeated 1 time(s)] > color zone #1 near sel distance 3 [Repeated 2 time(s)] > color zone #1 near sel distance 5 [Repeated 1 time(s)] > color zone #1 near sel distance 6 > hide #!1 models > show #!2 models > style sel sphere Changed 9255 atom styles > show #!1 models > hide #!1 models > hide sel cartoons > hide sel atoms > show sel atoms > style sel stick Changed 9255 atom styles > style sel ball Changed 9255 atom styles > show #!1 models > hide #!2 models > color zone #1 near sel distance 3 > color zone #1 near sel distance 5 [Repeated 1 time(s)] > color zone #1 near sel distance 300 > color zone #1 near sel distance 3 [Repeated 1 time(s)] > show #!2 models > hide #!1 models > style sel stick Changed 9255 atom styles > show #!1 models > hide #!2 models > view list Named views: Cys-trimer-side, cys-trimer-side-view2 > view cys-trimer-side-view2 > view Cys-trimer-side > view cys-trimer-side-view2 > save /Users/biq2001/Documents/Work/Cys-story-figures-scrach/figure-2/Cys- > timer-color-map.cxs ——— End of log from Wed May 15 11:30:14 2024 ——— opened ChimeraX session > view list Named views: Cys-trimer-side, cys-trimer-side-view2 > view cys-trimer-side-view2 > open /Users/biq2001/Dropbox/Biao's_folder/Cys-and-D- > Asp/D-Asp/cryosparc_P59_J39_008_volume_map_sharp.mrc Opened cryosparc_P59_J39_008_volume_map_sharp.mrc as #3, grid size 256,256,256, pixel 1.08, shown at level 0.278, step 1, values float32 > volume #3 level 0.5221 > hide #!1 models > view orient > view list Named views: Cys-trimer-side, cys-trimer-side-view2 > view cys-trimer-side-view2 > hide #!3 models > show #!1 models > hide #!1 models > show #!3 models > volume #3 level 0.5832 > show #!1 models > select #3 2 models selected > ui mousemode right translate > undo > select #3 2 models selected > view list Named views: Cys-trimer-side, cys-trimer-side-view2 > view cys-trimer-side-view2 > select #3 2 models selected > ui mousemode right "translate selected models" > view matrix models #3,1,0,0,-10.058,0,1,0,-11.987,0,0,1,-21.186 > select clear > ui tool show "Fit in Map" > fitmap #3 inMap #1 Fit map cryosparc_P59_J39_008_volume_map_sharp.mrc in map cryosparc_P61_J150_008_volume_map_sharp.mrc using 44135 points correlation = 0.2536, correlation about mean = 0.0612, overlap = 1.221e+04 steps = 84, shift = 0.984, angle = 3.62 degrees Position of cryosparc_P59_J39_008_volume_map_sharp.mrc (#3) relative to cryosparc_P61_J150_008_volume_map_sharp.mrc (#1) coordinates: Matrix rotation and translation 0.99991380 0.01102271 -0.00713362 -10.30561405 -0.01144282 0.99802235 -0.06180974 -1.91480729 0.00643820 0.06188604 0.99806246 -29.57859378 Axis 0.97822081 -0.10732969 -0.17766368 Axis point 0.00000000 489.50611572 -54.66462081 Rotation angle (degrees) 3.62493611 Shift along axis -4.62060860 > select #3 2 models selected > view matrix models > #3,0.99991,0.011023,-0.0071336,-10.855,-0.011443,0.99802,-0.06181,-3.2356,0.0064382,0.061886,0.99806,-31 > fitmap #3 inMap #1 Fit map cryosparc_P59_J39_008_volume_map_sharp.mrc in map cryosparc_P61_J150_008_volume_map_sharp.mrc using 44135 points correlation = 0.2536, correlation about mean = 0.06103, overlap = 1.221e+04 steps = 68, shift = 2.02, angle = 0.00625 degrees Position of cryosparc_P59_J39_008_volume_map_sharp.mrc (#3) relative to cryosparc_P61_J150_008_volume_map_sharp.mrc (#1) coordinates: Matrix rotation and translation 0.99991308 0.01111236 -0.00709520 -10.31114501 -0.01152961 0.99802441 -0.06176037 -1.91436172 0.00639488 0.06183681 0.99806579 -29.56350258 Axis 0.97801118 -0.10674552 -0.17916341 Axis point 0.00000000 489.66143107 -54.58168901 Rotation angle (degrees) 3.62282061 Shift along axis -4.58336752 > ui mousemode right "rotate selected models" > view matrix models > #3,0.94589,0.32339,0.02668,-50.56,-0.31394,0.93284,-0.17675,66.272,-0.082047,0.15881,0.98389,-28.404 > ui mousemode right "translate selected models" > view matrix models > #3,0.94589,0.32339,0.02668,-52.716,-0.31394,0.93284,-0.17675,66.3,-0.082047,0.15881,0.98389,-27.57 > fitmap #3 inMap #1 Fit map cryosparc_P59_J39_008_volume_map_sharp.mrc in map cryosparc_P61_J150_008_volume_map_sharp.mrc using 44135 points correlation = 0.9155, correlation about mean = 0.8071, overlap = 6.729e+04 steps = 132, shift = 5.38, angle = 14.2 degrees Position of cryosparc_P59_J39_008_volume_map_sharp.mrc (#3) relative to cryosparc_P61_J150_008_volume_map_sharp.mrc (#1) coordinates: Matrix rotation and translation 0.98798460 0.15455222 -0.00019946 -33.56844060 -0.15455221 0.98798462 0.00007039 8.95092523 0.00020795 -0.00003872 0.99999998 -23.54676633 Axis -0.00035297 -0.00131803 -0.99999907 Axis point 40.98681707 220.33071720 0.00000000 Rotation angle (degrees) 8.89083564 Shift along axis 23.54679548 > select clear > hide #!1 models > volume #3 level 0.614 > hide #!3 models > show #!1 models > show #!3 models > hide #!3 models > hide #!1 models > show #!3 models > open /Users/biq2001/Dropbox/Biao's_folder/Cys-and-D-Asp/D-Asp/iOFS*-DAS- > fitJ39-RSR-45-coot-14.pdb Summary of feedback from opening /Users/biq2001/Dropbox/Biao's_folder/Cys-and- D-Asp/D-Asp/iOFS*-DAS-fitJ39-RSR-45-coot-14.pdb --- warnings | Duplicate atom serial number found: 1 Duplicate atom serial number found: 2 Duplicate atom serial number found: 3 Duplicate atom serial number found: 4 Duplicate atom serial number found: 5 6193 messages similar to the above omitted Chain information for iOFS*-DAS-fitJ39-RSR-45-coot-14.pdb #4 --- Chain | Description A B C | No description available > ui tool show Matchmaker > matchmaker #!4 to #2 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 iOFS*-GlufitJ150.pdb, chain A (#2) with iOFS*-DAS- fitJ39-RSR-45-coot-14.pdb, chain A (#4), sequence alignment score = 1972.4 RMSD between 401 pruned atom pairs is 0.505 angstroms; (across all 406 pairs: 0.601) > color #4:13-83, 125-275 wheat > hide #!3 models > hide #!4 cartoons > hide #!4 atoms > show #!4 cartoons > color #4: 84-124, 276-500 plum > show #!2 models > hide #!4 models > show #!2 cartoons > hide #!2 cartoons > hide #!2 atoms > show #!2 cartoons > hide #!2 models > show #!4 models > show #!3 models > ui tool show "Color Zone" > color zone #3 near #4 distance 6.46 > color zone #3 near #4 distance 5 [Repeated 1 time(s)] > color zone #3 near #4 distance 3 [Repeated 1 time(s)] > surface dust #3 size 10.8 > view list Named views: Cys-trimer-side, cys-trimer-side-view2 > view cys-trimer-side-view2 > hide #!3 models > hide #!4 models > show #!4 models > hide #!4 models > show #!3 models > show #!4 models > hide #!3 models > show #!3 models > hide #!3 models > hide #!4 models > show #!1 models > hide #!1 models > show #!3 models > hide #!3 models > show #!4 models > hide #!4 cartoons [Repeated 1 time(s)] > show #!4 atoms > hide #!4 cartoons [Repeated 2 time(s)] > hide #!4 atoms > show #!4 cartoons > show #!3 models > hide #!3 models > hide #!4 models > show #!4 models > select $3:10-500 Expected an objects specifier or a keyword > select #3:10-500 Nothing selected > select #4:10-500 9255 atoms, 9393 bonds, 6 pseudobonds, 1218 residues, 2 models selected > color zone #3 near sel distance 3 > show #!3 models > show #!2 models > hide #!4 models > hide #!3 models > hide #!2 models > show #!1 models > show #!3 models > hide #!1 models > view name Missing or invalid "name" argument: Expected a text string > view list Named views: Cys-trimer-side, cys-trimer-side-view2 > view list Named views: Cys-trimer-side, cys-trimer-side-view2 > log > color zone #3 near sel distance 2 [Repeated 1 time(s)] > select #4:10-500 9255 atoms, 9393 bonds, 6 pseudobonds, 1218 residues, 2 models selected > color zone #3 near sel distance 2 > select #4:10-500 9255 atoms, 9393 bonds, 6 pseudobonds, 1218 residues, 2 models selected > show #!4 models > color zone #3 near sel distance 2 [Repeated 1 time(s)] > color zone #3 near sel distance 3 [Repeated 7 time(s)] > color zone #3 near sel distance 5 [Repeated 1 time(s)] > color zone #3 near sel distance 3 [Repeated 2 time(s)] > color zone #3 near sel distance 2 [Repeated 5 time(s)] > hide #!4 models > hide #!3 models > show #!3 models > show #!4 models > color zone #3 near sel distance 3 [Repeated 2 time(s)] > color zone #3 near sel distance 3.5 [Repeated 1 time(s)] > color zone #3 near sel distance 2.05 [Repeated 1 time(s)] > color zone #3 near sel distance 2.12 > color zone #3 near sel distance 5.58 > color zone #3 near sel distance 5.27 > color zone #3 near sel distance 3 > view list Named views: Cys-trimer-side, cys-trimer-side-view2 > view cys-trimer-side-view2 > hide #!4 models > hide #!3 models > show #!2 models > show #!1 models > hide #!2 models > show #!2 models > hide #!2 models > show #!4 models > hide #!4 models > show #!3 models > hide #!3 models > hide #!1 models > show #!3 models > show #!4 models > hide #!3 models > show sel atoms > hide sel cartoons > style sel stick Changed 9255 atom styles > style sel ball Changed 9255 atom styles > show #!3 models > hide #!3 models > style sel stick Changed 9255 atom styles > show #!3 models > volume #3 level 0.1657 > volume #3 level 0.614 > view list Named views: Cys-trimer-side, cys-trimer-side-view2 > view cys-trimer-side-view2 > save /Users/biq2001/Documents/Work/Cys-story-figures-scrach/figure-2/all- > ligand-color-map.cxs ——— End of log from Thu May 16 16:26:30 2024 ——— opened ChimeraX session > hide #!3 models > show #!1 models > hide #!4 models > select add #4 9297 atoms, 9417 bonds, 6 pseudobonds, 1236 residues, 2 models selected > open /Users/biq2001/Dropbox/Biao's_folder/Cys-and-D-Asp/iOFS-L-Asp- > Trimer/cryosparc_P100_J155_008_volume_map_sharp.mrc Opened cryosparc_P100_J155_008_volume_map_sharp.mrc as #5, grid size 240,240,240, pixel 1.16, shown at level 0.238, step 1, values float32 > hide #!1 models > volume #5 level 0.5038 > show #!3 models > hide #!3 models > select #5 2 models selected > ui mousemode right "translate selected models" > ui mousemode right "rotate selected models" > view matrix models > #5,0.33855,-0.72667,-0.59778,282.92,-0.71099,0.21858,-0.66837,308.02,0.61635,0.65129,-0.44265,39.142 > view matrix models > #5,0.12434,-0.98778,0.094018,245.6,-0.92369,-0.080622,0.37456,223.18,-0.36241,-0.13342,-0.92242,357.28 > show #!1 models > ui mousemode right "translate selected models" > view matrix models > #5,0.12434,-0.98778,0.094018,245.72,-0.92369,-0.080622,0.37456,234.64,-0.36241,-0.13342,-0.92242,343.26 > view matrix models > #5,0.12434,-0.98778,0.094018,236.1,-0.92369,-0.080622,0.37456,210.44,-0.36241,-0.13342,-0.92242,332.37 > ui mousemode right "rotate selected models" > view matrix models > #5,0.22084,-0.97531,0.0018087,234.53,-0.90313,-0.20379,0.37792,223.95,-0.36822,-0.085091,-0.92584,327.06 > view matrix models > #5,0.70144,-0.71272,0.0011371,130.53,-0.70313,-0.69173,0.16467,294.62,-0.11658,-0.1163,-0.98635,304.79 > view matrix models > #5,0.64103,-0.73393,-0.22458,175.77,-0.75726,-0.65245,-0.029259,325.9,-0.12505,0.18882,-0.97402,262.21 > view matrix models > #5,0.66075,-0.70287,0.2634,95.695,-0.68643,-0.7078,-0.16683,344.07,0.3037,-0.070573,-0.95015,233.62 > view matrix models > #5,0.70933,-0.69412,0.12263,108.68,-0.68313,-0.71985,-0.1231,338.72,0.17372,0.0035526,-0.98479,247.01 > view matrix models > #5,0.90043,-0.42625,0.086751,50.192,-0.40415,-0.89354,-0.19557,333.95,0.16088,0.14104,-0.97685,228.74 > view matrix models > #5,0.75412,-0.6558,-0.03509,120.68,-0.64504,-0.72959,-0.2272,350.24,0.1234,0.19397,-0.97322,226.23 > ui tool show "Fit in Map" > fitmap #5 inMap #1 Fit map cryosparc_P100_J155_008_volume_map_sharp.mrc in map cryosparc_P61_J150_008_volume_map_sharp.mrc using 42254 points correlation = 0.2219, correlation about mean = 0.03239, overlap = 9620 steps = 92, shift = 2.03, angle = 4.76 degrees Position of cryosparc_P100_J155_008_volume_map_sharp.mrc (#5) relative to cryosparc_P61_J150_008_volume_map_sharp.mrc (#1) coordinates: Matrix rotation and translation 0.77036592 -0.63611202 0.04356409 105.61079017 -0.61105813 -0.75607860 -0.23442080 350.59906350 0.18205577 0.15396961 -0.97115861 222.18562015 Axis 0.94017631 -0.33524668 0.06064795 Axis point 0.00000000 181.77647009 127.06380850 Rotation angle (degrees) 168.07963887 Shift along axis -4.76930740 > fitmap #5 inMap #3 Fit map cryosparc_P100_J155_008_volume_map_sharp.mrc in map cryosparc_P59_J39_008_volume_map_sharp.mrc using 42254 points correlation = 0.2794, correlation about mean = 0.03792, overlap = 1.236e+04 steps = 112, shift = 1.63, angle = 7.1 degrees Position of cryosparc_P100_J155_008_volume_map_sharp.mrc (#5) relative to cryosparc_P59_J39_008_volume_map_sharp.mrc (#3) coordinates: Matrix rotation and translation 0.90048967 -0.43153651 0.05380142 71.23710333 -0.42093825 -0.89600200 -0.14139098 346.30685931 0.10922155 0.10467404 -0.98849077 264.69452092 Axis 0.97470255 -0.21952792 0.04198141 Axis point 0.00000000 172.57779889 142.10226702 Rotation angle (degrees) 172.74845604 Shift along axis 4.52320995 > show #!2 models > hide #!1 models > show #!1 models > show #!3 models > hide #!1 models > view matrix models > #5,0.91591,-0.39926,0.041284,53.138,-0.38143,-0.89777,-0.22026,337.23,0.12501,0.18599,-0.97457,225.68 > fitmap #5 inMap #3 Fit map cryosparc_P100_J155_008_volume_map_sharp.mrc in map cryosparc_P59_J39_008_volume_map_sharp.mrc using 42254 points correlation = 0.2844, correlation about mean = 0.06045, overlap = 1.293e+04 steps = 168, shift = 3.7, angle = 5.39 degrees Position of cryosparc_P100_J155_008_volume_map_sharp.mrc (#5) relative to cryosparc_P59_J39_008_volume_map_sharp.mrc (#3) coordinates: Matrix rotation and translation 0.93692161 -0.32707435 0.12328933 38.29272450 -0.30067741 -0.93401597 -0.19289182 340.98515961 0.17824417 0.14365420 -0.97344362 245.86383568 Axis 0.98398515 -0.16067564 0.07717873 Axis point 0.00000000 162.86356567 136.36862016 Rotation angle (degrees) 170.15335131 Shift along axis 1.86692228 > fitmap #5 inMap #3 Fit map cryosparc_P100_J155_008_volume_map_sharp.mrc in map cryosparc_P59_J39_008_volume_map_sharp.mrc using 42254 points correlation = 0.2845, correlation about mean = 0.06058, overlap = 1.294e+04 steps = 40, shift = 0.014, angle = 0.0582 degrees Position of cryosparc_P100_J155_008_volume_map_sharp.mrc (#5) relative to cryosparc_P59_J39_008_volume_map_sharp.mrc (#3) coordinates: Matrix rotation and translation 0.93661885 -0.32796262 0.12323008 38.45880372 -0.30161880 -0.93376555 -0.19263435 341.03277028 0.17824487 0.14325645 -0.97350211 245.93206335 Axis 0.98390811 -0.16115207 0.07716764 Axis point 0.00000000 162.92703997 136.37122359 Rotation angle (degrees) 170.17193494 Shift along axis 1.85978909 > view matrix models > #5,0.79963,-0.59231,0.098792,84.321,-0.57293,-0.8018,-0.1699,342.84,0.17985,0.07926,-0.9805,232.02 > ui mousemode right "translate selected models" > view matrix models > #5,0.79963,-0.59231,0.098792,82.009,-0.57293,-0.8018,-0.1699,340.99,0.17985,0.07926,-0.9805,232.95 > fitmap #5 inMap #3 Fit map cryosparc_P100_J155_008_volume_map_sharp.mrc in map cryosparc_P59_J39_008_volume_map_sharp.mrc using 42254 points correlation = 0.3878, correlation about mean = 0.1191, overlap = 1.897e+04 steps = 132, shift = 2.58, angle = 13.5 degrees Position of cryosparc_P100_J155_008_volume_map_sharp.mrc (#5) relative to cryosparc_P59_J39_008_volume_map_sharp.mrc (#3) coordinates: Matrix rotation and translation 0.94080033 -0.33896115 0.00026654 53.87686734 -0.33896101 -0.94080030 -0.00046289 315.99131341 0.00040766 0.00034514 -0.99999985 297.08399870 Axis 0.98508882 -0.17204647 0.00017083 Axis point 0.00000000 162.66955152 148.57019566 Rotation angle (degrees) 179.97650110 Shift along axis -1.24094134 > fitmap #5 inMap #3 Fit map cryosparc_P100_J155_008_volume_map_sharp.mrc in map cryosparc_P59_J39_008_volume_map_sharp.mrc using 42254 points correlation = 0.3877, correlation about mean = 0.1188, overlap = 1.896e+04 steps = 28, shift = 0.0264, angle = 0.0178 degrees Position of cryosparc_P100_J155_008_volume_map_sharp.mrc (#5) relative to cryosparc_P59_J39_008_volume_map_sharp.mrc (#3) coordinates: Matrix rotation and translation 0.94069777 -0.33924570 0.00025699 53.93193243 -0.33924553 -0.94069771 -0.00053006 316.02750096 0.00042158 0.00041144 -0.99999982 297.09922376 Axis 0.98506280 -0.17219537 0.00017198 Axis point 0.00000000 162.69154302 148.58320706 Rotation angle (degrees) 179.97261895 Shift along axis -1.24103709 > view matrix models > #5,0.87696,-0.48056,0.00037145,67.57,-0.48056,-0.87696,-0.0006338,310.66,0.00063032,0.00037732,-1,272.8 > fitmap #5 inMap #3 Fit map cryosparc_P100_J155_008_volume_map_sharp.mrc in map cryosparc_P59_J39_008_volume_map_sharp.mrc using 42254 points correlation = 0.3877, correlation about mean = 0.1188, overlap = 1.896e+04 steps = 60, shift = 2.51, angle = 0.00722 degrees Position of cryosparc_P100_J155_008_volume_map_sharp.mrc (#5) relative to cryosparc_P59_J39_008_volume_map_sharp.mrc (#3) coordinates: Matrix rotation and translation 0.94065549 -0.33936292 0.00023881 53.95719752 -0.33936276 -0.94065543 -0.00052778 316.03757417 0.00040375 0.00041541 -0.99999983 297.10014316 Axis 0.98505207 -0.17225675 0.00016285 Axis point 0.00000000 162.70045468 148.58398552 Rotation angle (degrees) 179.97256951 Shift along axis -1.24057449 > fitmap #5 inMap #3 Fit map cryosparc_P100_J155_008_volume_map_sharp.mrc in map cryosparc_P59_J39_008_volume_map_sharp.mrc using 42254 points correlation = 0.3879, correlation about mean = 0.119, overlap = 1.897e+04 steps = 28, shift = 0.0251, angle = 0.0123 degrees Position of cryosparc_P100_J155_008_volume_map_sharp.mrc (#5) relative to cryosparc_P59_J39_008_volume_map_sharp.mrc (#3) coordinates: Matrix rotation and translation 0.94072624 -0.33916672 0.00026887 53.91680347 -0.33916657 -0.94072621 -0.00048715 316.01382397 0.00041816 0.00036708 -0.99999984 297.07982204 Axis 0.98507002 -0.17215407 0.00017410 Axis point 0.00000000 162.68556005 148.56989705 Rotation angle (degrees) 179.97515719 Shift along axis -1.23951695 > view matrix models > #5,0.877,-0.48048,0.00038981,65.724,-0.48048,-0.877,-0.00059324,307.79,0.00062691,0.00033298,-1,274.79 > view matrix models > #5,0.877,-0.48048,0.00038981,65.744,-0.48048,-0.877,-0.00059324,307.83,0.00062691,0.00033298,-1,274.8 > view matrix models > #5,0.877,-0.48048,0.00038981,66.394,-0.48048,-0.877,-0.00059324,309.16,0.00062691,0.00033298,-1,273.65 > view matrix models > #5,0.877,-0.48048,0.00038981,68.158,-0.48048,-0.877,-0.00059324,308.97,0.00062691,0.00033298,-1,273.01 > ui mousemode right "rotate selected models" > view matrix models > #5,0.82496,-0.56462,0.025344,83.352,-0.56401,-0.81954,0.10118,297.66,-0.036357,-0.097763,-0.99455,290.91 > fitmap #5 inMap #3 Fit map cryosparc_P100_J155_008_volume_map_sharp.mrc in map cryosparc_P59_J39_008_volume_map_sharp.mrc using 42254 points correlation = 0.9602, correlation about mean = 0.8774, overlap = 6.895e+04 steps = 100, shift = 5.97, angle = 7.35 degrees Position of cryosparc_P100_J155_008_volume_map_sharp.mrc (#5) relative to cryosparc_P59_J39_008_volume_map_sharp.mrc (#3) coordinates: Matrix rotation and translation 0.93167673 -0.36328839 -0.00006493 58.61574286 -0.36328839 -0.93167674 0.00004534 317.97969905 -0.00007697 -0.00001866 -0.99999999 291.84096413 Axis -0.98277202 0.18482195 0.00003266 Axis point 0.00000000 164.50396003 145.91882412 Rotation angle (degrees) 179.99813436 Shift along axis 1.17324751 > hide #!2 models > show #!1 models > select clear > fitmap #5 inMap #1 Fit map cryosparc_P100_J155_008_volume_map_sharp.mrc in map cryosparc_P61_J150_008_volume_map_sharp.mrc using 42254 points correlation = 0.8958, correlation about mean = 0.7764, overlap = 6.158e+04 steps = 40, shift = 0.0035, angle = 0.00485 degrees Position of cryosparc_P100_J155_008_volume_map_sharp.mrc (#5) relative to cryosparc_P61_J150_008_volume_map_sharp.mrc (#1) coordinates: Matrix rotation and translation 0.86429891 -0.50297849 0.00016509 73.43999913 -0.50297850 -0.86429892 0.00002232 314.06928799 0.00013147 -0.00010233 -0.99999998 268.30361728 Axis -0.96547979 0.26047798 -0.00007880 Axis point 0.00000000 166.94586249 134.14360939 Rotation angle (degrees) 179.99630154 Shift along axis 10.88215617 > fitmap #5 inMap #1 Fit map cryosparc_P100_J155_008_volume_map_sharp.mrc in map cryosparc_P61_J150_008_volume_map_sharp.mrc using 42254 points correlation = 0.8958, correlation about mean = 0.7764, overlap = 6.158e+04 steps = 28, shift = 0.00213, angle = 0.00901 degrees Position of cryosparc_P100_J155_008_volume_map_sharp.mrc (#5) relative to cryosparc_P61_J150_008_volume_map_sharp.mrc (#1) coordinates: Matrix rotation and translation 0.86422684 -0.50310234 0.00010050 73.47888859 -0.50310234 -0.86422684 0.00002764 314.07494354 0.00007295 -0.00007445 -0.99999999 268.30782702 Axis -0.96546132 0.26054641 -0.00004737 Axis point 0.00000000 166.95591868 134.14784966 Rotation angle (degrees) 179.99697055 Shift along axis 10.87736417 > open /Users/biq2001/Dropbox/Biao's_folder/Cys-and-D-Asp/iOFS-L-Asp- > Trimer/iOFS_-LAsp-fit-J155-RSR18-coot-13.pdb Summary of feedback from opening /Users/biq2001/Dropbox/Biao's_folder/Cys-and- D-Asp/iOFS-L-Asp-Trimer/iOFS_-LAsp-fit-J155-RSR18-coot-13.pdb --- warnings | Duplicate atom serial number found: 1 Duplicate atom serial number found: 2 Duplicate atom serial number found: 3 Duplicate atom serial number found: 4 Duplicate atom serial number found: 5 6199 messages similar to the above omitted Chain information for iOFS_-LAsp-fit-J155-RSR18-coot-13.pdb #6 --- Chain | Description A B C | No description available > ui tool show Matchmaker > matchmaker #!6 to #2 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 iOFS*-GlufitJ150.pdb, chain A (#2) with iOFS_-LAsp- fit-J155-RSR18-coot-13.pdb, chain A (#6), sequence alignment score = 2003 RMSD between 401 pruned atom pairs is 0.499 angstroms; (across all 406 pairs: 0.606) > hide #!1 models > hide #!5 models > show #!2 models > hide #!2 models > hide #!3 models > hide #!6 atoms > color #6: 84-124, 276-500 skyblue > color #4:13-83, 125-275 wheat > color #6:13-83, 125-275 wheat > select #5:1-500 Nothing selected > select #6:1-500 9255 atoms, 9393 bonds, 6 pseudobonds, 1218 residues, 2 models selected > ui tool show "Color Zone" > color zone #5 near sel distance 3 > show #!5 models > view matrix models > #6,-0.67762,-0.72448,0.12632,300.46,-0.7324,0.68034,-0.026877,135.28,-0.066467,-0.11073,-0.99163,291.79 > view matrix models > #6,-0.83986,-0.53079,0.11357,297.93,-0.53464,0.84507,-0.0041147,81.061,-0.093794,-0.064177,-0.99352,289.37 > undo [Repeated 1 time(s)] > select clear > ui mousemode right "translate selected models" > surface dust #5 size 11.6 > view list Named views: Cys-trimer-side, cys-trimer-side-view2 > view cys-trimer-side-view2 > volume #5 level 0.614 > hide #!6 models > hide #!5 models > show #!3 models > hide #!3 models > show #!6 models > hide #!6 models > show #!5 models > view list Named views: Cys-trimer-side, cys-trimer-side-view2 > view cys-trimer-side-view2 > lighting simple > lighting soft > show #!1 models > hide #!5 models > hide #!1 models > show #!1 models > show #!3 models > show #!5 models > hide #!3 models > hide #!5 models > open > /Users/biq2001/Dropbox/Biao's_folder/R-2HG-300Kv/cryosparc_P113_J33_009_volume_map_sharp.mrc Opened cryosparc_P113_J33_009_volume_map_sharp.mrc as #7, grid size 320,320,320, pixel 0.844, shown at level 0.13, step 2, values float32 > volume #7 step 1 > volume #7 level 0.2588 > hide #!1 models > show #!3 models > select #7 2 models selected > view matrix models #7,1,0,0,-13.679,0,1,0,-7.8079,0,0,1,-16.462 > ui mousemode right "rotate selected models" > view matrix models > #7,0.92031,-0.39099,0.012182,49.073,0.39022,0.91979,0.041453,-55.017,-0.027413,-0.033396,0.99907,-8.0573 > view matrix models > #7,0.8899,-0.45597,0.012985,61.982,0.45536,0.88966,0.033848,-58.609,-0.026987,-0.024209,0.99934,-9.4142 > ui tool show "Fit in Map" [Repeated 1 time(s)] > fitmap #7 inMap #3 Fit map cryosparc_P113_J33_009_volume_map_sharp.mrc in map cryosparc_P59_J39_008_volume_map_sharp.mrc using 111734 points correlation = 0.7367, correlation about mean = 0.557, overlap = 5.634e+04 steps = 120, shift = 4.27, angle = 6.98 degrees Position of cryosparc_P113_J33_009_volume_map_sharp.mrc (#7) relative to cryosparc_P59_J39_008_volume_map_sharp.mrc (#3) coordinates: Matrix rotation and translation 0.73524340 -0.67780312 0.00026368 129.93217046 0.67780317 0.73524337 -0.00020318 -53.12548622 -0.00005615 0.00032811 0.99999994 6.20312125 Axis 0.00039192 0.00023593 0.99999990 Axis point 132.97001462 139.75302306 0.00000000 Rotation angle (degrees) 42.67221631 Shift along axis 6.24150962 > fitmap #7 inMap #3 Fit map cryosparc_P113_J33_009_volume_map_sharp.mrc in map cryosparc_P59_J39_008_volume_map_sharp.mrc using 111734 points correlation = 0.7365, correlation about mean = 0.5563, overlap = 5.634e+04 steps = 36, shift = 0.013, angle = 0.0162 degrees Position of cryosparc_P113_J33_009_volume_map_sharp.mrc (#7) relative to cryosparc_P59_J39_008_volume_map_sharp.mrc (#3) coordinates: Matrix rotation and translation 0.73543410 -0.67759620 0.00028675 129.88092975 0.67759625 0.73543408 -0.00018346 -53.12569439 -0.00008658 0.00032922 0.99999994 6.21884555 Axis 0.00037831 0.00027548 0.99999989 Axis point 132.97326341 139.75635184 0.00000000 Rotation angle (degrees) 42.65609372 Shift along axis 6.25334495 > volume #7 level 0.3741 > view matrix models > #7,0.84088,-0.54106,0.013416,81.41,0.54097,0.84098,0.010147,-64.368,-0.016773,-0.0012749,0.99986,-14.837 > fitmap #7 inMap #3 Fit map cryosparc_P113_J33_009_volume_map_sharp.mrc in map cryosparc_P59_J39_008_volume_map_sharp.mrc using 76350 points correlation = 0.7588, correlation about mean = 0.5537, overlap = 5.336e+04 steps = 44, shift = 0.0501, angle = 1.39 degrees Position of cryosparc_P113_J33_009_volume_map_sharp.mrc (#7) relative to cryosparc_P59_J39_008_volume_map_sharp.mrc (#3) coordinates: Matrix rotation and translation 0.73546285 -0.67756498 0.00028914 129.86850420 0.67756502 0.73546287 -0.00006145 -53.14460946 -0.00017102 0.00024111 0.99999996 6.22633133 Axis 0.00022327 0.00033957 0.99999992 Axis point 132.99652522 139.74244929 0.00000000 Rotation angle (degrees) 42.65365998 Shift along axis 6.23728048 > select clear > view list Named views: Cys-trimer-side, cys-trimer-side-view2 > view list Named views: Cys-trimer-side, cys-trimer-side-view2 > view cys-trimer-side-view2 > select #7 2 models selected > ui mousemode right "translate selected models" > view matrix models > #7,0.83135,-0.55576,7.6709e-05,86.597,0.55576,0.83135,-3.5013e-05,-63.821,-4.4313e-05,7.1739e-05,1,-16.124 > ui tool show "Fit in Map" > select clear > open /Users/biq2001/Dropbox/Biao's_folder/R-2HG-300Kv/8cv3-iofs-Na- > fit-J33.pdb Chain information for 8cv3-iofs-Na-fit-J33.pdb #8 --- Chain | Description A | No description available > ui tool show Matchmaker > matchmaker #!8 to #2 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 iOFS*-GlufitJ150.pdb, chain A (#2) with 8cv3-iofs-Na-fit-J33.pdb, chain A (#8), sequence alignment score = 1933.4 RMSD between 272 pruned atom pairs is 1.066 angstroms; (across all 406 pairs: 2.311) > hide #!3 models > volume #7 level 0.238 > surface dust #7 size 8.44 > volume #7 level 0.34 > view list Named views: Cys-trimer-side, cys-trimer-side-view2 > view cys-trimer-side-view2 > color #8:13-83, 125-275 wheat > hide #!8 atoms > color #8: 84-124, 276-500 lightblue greenwheat Expected a collection of one of 'All', 'atoms', 'bonds', 'cartoons', 'labels', 'models', 'pseudobonds', 'ribbons', 'rings', or 'surfaces' or a keyword > color #8: 84-124, 276-500 light green > open /Users/biq2001/Dropbox/Biao's_folder/R-2HG-300Kv/OFS-Na-fit-J33.pdb Chain information for OFS-Na-fit-J33.pdb #9 --- Chain | Description A B C | No description available > ui tool show Matchmaker > matchmaker #!2 to #9 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 OFS-Na-fit-J33.pdb, chain A (#9) with iOFS*-GlufitJ150.pdb, chain A (#2), sequence alignment score = 1934.6 RMSD between 170 pruned atom pairs is 0.633 angstroms; (across all 406 pairs: 4.309) > ui tool show Matchmaker > matchmaker #!9 to #2 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 iOFS*-GlufitJ150.pdb, chain A (#2) with OFS-Na-fit-J33.pdb, chain A (#9), sequence alignment score = 1934.6 RMSD between 170 pruned atom pairs is 0.633 angstroms; (across all 406 pairs: 4.309) > hide #!8 models > show #!8 models > show #!2 models > hide #!9 models > show #!9 models > hide #!9 models > show #!9 models > hide #!9 models > show #!9 models > hide #!9 models > show #!7 models > hide #!2 models > show #!1 models > hide #!1 models > show #!2 models > hide #!2 models > show #!2 models > hide #!2 models > show #!2 models > hide #!2 models > show #!2 models > show #!1 models > hide #!1 models > close #8 > close #9 > show #!4 models > ui tool show Matchmaker > matchmaker #!2 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 iOFS*-DAS-fitJ39-RSR-45-coot-14.pdb, chain A (#4) with iOFS*-GlufitJ150.pdb, chain A (#2), sequence alignment score = 1972.4 RMSD between 401 pruned atom pairs is 0.505 angstroms; (across all 406 pairs: 0.601) > open /Users/biq2001/Dropbox/Biao's_folder/R-2HG-300Kv/OFS-Na-fit-J33.pdb Chain information for OFS-Na-fit-J33.pdb #8 --- Chain | Description A B C | No description available > ui tool show Matchmaker > matchmaker #!8 to #2 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 iOFS*-GlufitJ150.pdb, chain A (#2) with OFS-Na-fit-J33.pdb, chain A (#8), sequence alignment score = 1934.6 RMSD between 170 pruned atom pairs is 0.633 angstroms; (across all 406 pairs: 4.309) > hide #!2 models > hide #!7 models > hide #!4,8 cartoons > show #!4,8 cartoons > hide #!4,8 atoms > ui tool show "Fit in Map" > fitmap #8 inMap #7 Fit molecule OFS-Na-fit-J33.pdb (#8) to map cryosparc_P113_J33_009_volume_map_sharp.mrc (#7) using 9882 atoms average map value = 0.6546, steps = 68 shifted from previous position = 1.44 rotated from previous position = 1.58 degrees atoms outside contour = 3067, contour level = 0.34 Position of OFS-Na-fit-J33.pdb (#8) relative to cryosparc_P113_J33_009_volume_map_sharp.mrc (#7) coordinates: Matrix rotation and translation -0.50001312 -0.86601783 -0.00002826 319.62473921 0.86601783 -0.50001312 0.00006628 85.63380241 -0.00007153 0.00000867 1.00000000 0.00932509 Axis -0.00003326 0.00002498 1.00000000 Axis point 135.09245274 135.08300175 0.00000000 Rotation angle (degrees) 120.00086800 Shift along axis 0.00083368 > show #!7 models > hide #!7 models > hide #!8 models > hide #!4 models > show #!3 models > show #!7 models > hide #!7 models > show #!7 models > hide #!7 models > show #!7 models > hide #!7 models > show #!7 models > hide #!7 models > show #!7 models > hide #!7 models > show #!7 models > select #7 2 models selected > ui mousemode right "translate selected models" > view matrix models > #7,0.83135,-0.55576,7.6709e-05,86.268,0.55576,0.83135,-3.5013e-05,-63.572,-4.4313e-05,7.1739e-05,1,-16.469 > view matrix models > #7,0.83135,-0.55576,7.6709e-05,86.055,0.55576,0.83135,-3.5013e-05,-63.157,-4.4313e-05,7.1739e-05,1,-17.146 > view matrix models > #7,0.83135,-0.55576,7.6709e-05,86.264,0.55576,0.83135,-3.5013e-05,-63.27,-4.4313e-05,7.1739e-05,1,-17.499 > fitmap #7 inMap #3 Fit map cryosparc_P113_J33_009_volume_map_sharp.mrc in map cryosparc_P59_J39_008_volume_map_sharp.mrc using 84675 points correlation = 0.7523, correlation about mean = 0.5538, overlap = 5.425e+04 steps = 40, shift = 0.494, angle = 0.00559 degrees Position of cryosparc_P113_J33_009_volume_map_sharp.mrc (#7) relative to cryosparc_P59_J39_008_volume_map_sharp.mrc (#3) coordinates: Matrix rotation and translation 0.73545234 -0.67757640 0.00026944 129.87532572 0.67757645 0.73545233 -0.00015573 -53.13708384 -0.00009264 0.00029710 0.99999995 6.21315379 Axis 0.00033416 0.00026719 0.99999991 Axis point 132.98781870 139.75047451 0.00000000 Rotation angle (degrees) 42.65455030 Shift along axis 6.24235451 > fitmap #7 inMap #3 Fit map cryosparc_P113_J33_009_volume_map_sharp.mrc in map cryosparc_P59_J39_008_volume_map_sharp.mrc using 84675 points correlation = 0.7523, correlation about mean = 0.5537, overlap = 5.425e+04 steps = 28, shift = 0.0234, angle = 0.00342 degrees Position of cryosparc_P113_J33_009_volume_map_sharp.mrc (#7) relative to cryosparc_P59_J39_008_volume_map_sharp.mrc (#3) coordinates: Matrix rotation and translation 0.73545746 -0.67757083 0.00032865 129.85427072 0.67757089 0.73545745 -0.00015470 -53.11693771 -0.00013689 0.00033646 0.99999993 6.21612344 Axis 0.00036244 0.00034354 0.99999988 Axis point 132.95277375 139.73497491 0.00000000 Rotation angle (degrees) 42.65411830 Shift along axis 6.24493931 > fitmap #7 inMap #3 Fit map cryosparc_P113_J33_009_volume_map_sharp.mrc in map cryosparc_P59_J39_008_volume_map_sharp.mrc using 84675 points correlation = 0.7524, correlation about mean = 0.5538, overlap = 5.425e+04 steps = 28, shift = 0.021, angle = 0.00405 degrees Position of cryosparc_P113_J33_009_volume_map_sharp.mrc (#7) relative to cryosparc_P59_J39_008_volume_map_sharp.mrc (#3) coordinates: Matrix rotation and translation 0.73544331 -0.67758620 0.00027881 129.87321998 0.67758625 0.73544329 -0.00020035 -53.13004019 -0.00006930 0.00033626 0.99999994 6.20473431 Axis 0.00039597 0.00025687 0.99999989 Axis point 132.97613447 139.74756737 0.00000000 Rotation angle (degrees) 42.65531465 Shift along axis 6.24251236 > fitmap #8 inMap #7 Fit molecule OFS-Na-fit-J33.pdb (#8) to map cryosparc_P113_J33_009_volume_map_sharp.mrc (#7) using 9882 atoms average map value = 0.6545, steps = 52 shifted from previous position = 1.2 rotated from previous position = 0.00869 degrees atoms outside contour = 3071, contour level = 0.34 Position of OFS-Na-fit-J33.pdb (#8) relative to cryosparc_P113_J33_009_volume_map_sharp.mrc (#7) coordinates: Matrix rotation and translation -0.49993042 -0.86606557 -0.00002676 319.61976063 0.86606557 -0.49993042 0.00006905 85.61572117 -0.00007318 0.00001134 1.00000000 -0.00564482 Axis -0.00003332 0.00002680 1.00000000 Axis point 135.09245735 135.08269789 0.00000000 Rotation angle (degrees) 119.99539673 Shift along axis -0.01399909 > fitmap #8 inMap #7 Fit molecule OFS-Na-fit-J33.pdb (#8) to map cryosparc_P113_J33_009_volume_map_sharp.mrc (#7) using 9882 atoms average map value = 0.6545, steps = 40 shifted from previous position = 0.00401 rotated from previous position = 0.00962 degrees atoms outside contour = 3070, contour level = 0.34 Position of OFS-Na-fit-J33.pdb (#8) relative to cryosparc_P113_J33_009_volume_map_sharp.mrc (#7) coordinates: Matrix rotation and translation -0.50007001 -0.86598498 -0.00002809 319.62829963 0.86598498 -0.50007001 0.00002190 85.65576180 -0.00003301 -0.00001337 1.00000000 -0.00717938 Axis -0.00002036 0.00000284 1.00000000 Axis point 135.08976932 135.08801026 0.00000000 Rotation angle (degrees) 120.00463194 Shift along axis -0.01344468 > show #!8 models > select clear > view list Named views: Cys-trimer-side, cys-trimer-side-view2 > view cys-trimer-side-view2 > hide #!3 models > color #8: 84-124, 276-500 light green > color #8:13-83, 125-275 wheat > hide #!7 models > lighting simple > lighting soft > ui tool show "Color Zone" > color zone #7 near #8 distance 5.07 > show #!7 models > color zone #7 near #8 distance 3 [Repeated 2 time(s)] > show target m > hide target m > show #!7 models > show #!8 models > show target m > hide #!1 models > hide #!2 models > hide #!3 models > hide #!4 models > hide #!5 models > hide #!6 models > select add #7.1 1 model selected > view #7.1 clip false > show #7.1 target m > ui tool show "Model Panel" [Repeated 1 time(s)] > save /Users/biq2001/Documents/Work/Cys-story-figures-scrach/figure-2/all- > ligand-color-map.cxs ——— End of log from Fri May 17 16:45:44 2024 ——— opened ChimeraX session > volume #7 level 0.204 > select #8:1-500 9876 atoms, 10023 bonds, 3 pseudobonds, 1299 residues, 2 models selected > ui tool show "Color Zone" > color zone #5 near #8 distance 1.16 > color zone #7 near sel distance 3 [Repeated 1 time(s)] > hide #!8 models > show #!8 models > hide #!7 models > hide #!8 models > show #!8 models > show #!7 models > hide #!8 models > volume #7 level 0.34 > hide #!5 models > show #!7 models > show #!8 models > hide #!8 models > hide #!7 models > show #!6 models > hide #!6 models > show #!5 models > hide #!5 models > show #!3 models > hide #!3 models > show #!7 models > hide #!7 models > show #!7 models > color #7 gray > hide #!7 models > show #!1 models > show #!7 models > color #7 dark gray > color #7 darkgray > color #7 silver > hide #!7 models > show #!7 models > hide #!7 models > color #7 light gray > color #5 #bfbfbfff models > show #!7 models > hide #!7 models > hide #!1 models > show #!1 models > hide #!1 models > show #!7 models > color #7 dark gray > show #!1 models > hide #!7 models > show #!7 models > hide #!7 models > show #!7 models > hide #!7 models > show #!7 models > hide #!7 models > show #!7 models > hide #!7 models > show #!7 models > hide #!7 models > show #!7 models > hide #!7 models > show #!7 models > color #7 light gray > color #7 silver > hide #!7 models > show #!7 models > hide #!7 models > show #!7 models > initial color Unknown command: initial color > initial colors Unknown command: initial colors > initialColors Unknown command: initialColors > save /Users/biq2001/Documents/Work/Cys-story-figures-scrach/figure-2/all- > ligand-color-map.cxs ——— End of log from Fri May 17 17:01:07 2024 ——— opened ChimeraX session OpenGL version: 4.1 INTEL-20.7.2 OpenGL renderer: Intel(R) Iris(TM) Plus Graphics 640 OpenGL vendor: Intel Inc. Python: 3.9.11 Locale: UTF-8 Qt version: PyQt6 6.4.2, Qt 6.4.2 Qt runtime version: 6.4.3 Qt platform: cocoa Hardware: Hardware Overview: Model Name: MacBook Pro Model Identifier: MacBookPro14,1 Processor Name: Dual-Core Intel Core i5 Processor Speed: 2.3 GHz Number of Processors: 1 Total Number of Cores: 2 L2 Cache (per Core): 256 KB L3 Cache: 4 MB Hyper-Threading Technology: Enabled Memory: 8 GB System Firmware Version: 526.0.0.0.0 OS Loader Version: 577.140.2~22 SMC Version (system): 2.43f11 Software: System Software Overview: System Version: macOS 13.6.6 (22G630) Kernel Version: Darwin 22.6.0 Time since boot: 13 hours, 11 minutes Graphics/Displays: Intel Iris Plus Graphics 640: Chipset Model: Intel Iris Plus Graphics 640 Type: GPU Bus: Built-In VRAM (Dynamic, Max): 1536 MB Vendor: Intel Device ID: 0x5926 Revision ID: 0x0006 Metal Support: Metal 3 Displays: Color LCD: Display Type: Built-In Retina LCD Resolution: 2560 x 1600 Retina Framebuffer Depth: 30-Bit Color (ARGB2101010) Main Display: Yes Mirror: Off Online: Yes Automatically Adjust Brightness: No Connection Type: Internal DELL U2917W: Resolution: 2560 x 1080 (UW-UXGA - Ultra Wide - Ultra Extended Graphics Array) UI Looks like: 2560 x 1080 @ 60.00Hz Framebuffer Depth: 30-Bit Color (ARGB2101010) Display Serial Number: 0PRH47BPALTL Mirror: Off Online: Yes Rotation: Supported Connection Type: Thunderbolt/DisplayPort Installed Packages: alabaster: 0.7.13 appdirs: 1.4.4 appnope: 0.1.3 asttokens: 2.2.1 Babel: 2.12.1 backcall: 0.2.0 beautifulsoup4: 4.11.2 blockdiag: 3.0.0 build: 0.10.0 certifi: 2021.10.8 cftime: 1.6.2 charset-normalizer: 3.1.0 ChimeraX-AddCharge: 1.5.9.1 ChimeraX-AddH: 2.2.5 ChimeraX-AlignmentAlgorithms: 2.0.1 ChimeraX-AlignmentHdrs: 3.3.1 ChimeraX-AlignmentMatrices: 2.1 ChimeraX-Alignments: 2.9.3 ChimeraX-AlphaFold: 1.0 ChimeraX-AltlocExplorer: 1.0.3 ChimeraX-AmberInfo: 1.0 ChimeraX-Arrays: 1.1 ChimeraX-Atomic: 1.43.10 ChimeraX-AtomicLibrary: 10.0.6 ChimeraX-AtomSearch: 2.0.1 ChimeraX-AxesPlanes: 2.3.2 ChimeraX-BasicActions: 1.1.2 ChimeraX-BILD: 1.0 ChimeraX-BlastProtein: 2.1.2 ChimeraX-BondRot: 2.0.1 ChimeraX-BugReporter: 1.0.1 ChimeraX-BuildStructure: 2.8 ChimeraX-Bumps: 1.0 ChimeraX-BundleBuilder: 1.2.2 ChimeraX-ButtonPanel: 1.0.1 ChimeraX-CageBuilder: 1.0.1 ChimeraX-CellPack: 1.0 ChimeraX-Centroids: 1.3.2 ChimeraX-ChangeChains: 1.0.2 ChimeraX-CheckWaters: 1.3.1 ChimeraX-ChemGroup: 2.0.1 ChimeraX-Clashes: 2.2.4 ChimeraX-Clipper: 0.21.0 ChimeraX-ColorActions: 1.0.3 ChimeraX-ColorGlobe: 1.0 ChimeraX-ColorKey: 1.5.3 ChimeraX-CommandLine: 1.2.5 ChimeraX-ConnectStructure: 2.0.1 ChimeraX-Contacts: 1.0.1 ChimeraX-Core: 1.6.1 ChimeraX-CoreFormats: 1.1 ChimeraX-coulombic: 1.4.2 ChimeraX-Crosslinks: 1.0 ChimeraX-Crystal: 1.0 ChimeraX-CrystalContacts: 1.0.1 ChimeraX-DataFormats: 1.2.3 ChimeraX-Dicom: 1.2 ChimeraX-DistMonitor: 1.4 ChimeraX-DockPrep: 1.1.1 ChimeraX-Dssp: 2.0 ChimeraX-EMDB-SFF: 1.0 ChimeraX-ESMFold: 1.0 ChimeraX-FileHistory: 1.0.1 ChimeraX-FunctionKey: 1.0.1 ChimeraX-Geometry: 1.3 ChimeraX-gltf: 1.0 ChimeraX-Graphics: 1.1.1 ChimeraX-Hbonds: 2.4 ChimeraX-Help: 1.2.1 ChimeraX-HKCage: 1.3 ChimeraX-IHM: 1.1 ChimeraX-ImageFormats: 1.2 ChimeraX-IMOD: 1.0 ChimeraX-IO: 1.0.1 ChimeraX-ISOLDE: 1.6.0 ChimeraX-ItemsInspection: 1.0.1 ChimeraX-Label: 1.1.7 ChimeraX-ListInfo: 1.1.1 ChimeraX-Log: 1.1.5 ChimeraX-LookingGlass: 1.1 ChimeraX-Maestro: 1.8.2 ChimeraX-Map: 1.1.4 ChimeraX-MapData: 2.0 ChimeraX-MapEraser: 1.0.1 ChimeraX-MapFilter: 2.0.1 ChimeraX-MapFit: 2.0 ChimeraX-MapSeries: 2.1.1 ChimeraX-Markers: 1.0.1 ChimeraX-Mask: 1.0.2 ChimeraX-MatchMaker: 2.0.12 ChimeraX-MDcrds: 2.6 ChimeraX-MedicalToolbar: 1.0.2 ChimeraX-Meeting: 1.0.1 ChimeraX-MLP: 1.1.1 ChimeraX-mmCIF: 2.12 ChimeraX-MMTF: 2.2 ChimeraX-Modeller: 1.5.9 ChimeraX-ModelPanel: 1.3.7 ChimeraX-ModelSeries: 1.0.1 ChimeraX-Mol2: 2.0 ChimeraX-Mole: 1.0 ChimeraX-Morph: 1.0.2 ChimeraX-MouseModes: 1.2 ChimeraX-Movie: 1.0 ChimeraX-Neuron: 1.0 ChimeraX-Nifti: 1.0 ChimeraX-NRRD: 1.0 ChimeraX-Nucleotides: 2.0.3 ChimeraX-OpenCommand: 1.10.1 ChimeraX-PDB: 2.7.2 ChimeraX-PDBBio: 1.0 ChimeraX-PDBLibrary: 1.0.2 ChimeraX-PDBMatrices: 1.0 ChimeraX-PickBlobs: 1.0.1 ChimeraX-Positions: 1.0 ChimeraX-PresetMgr: 1.1 ChimeraX-PubChem: 2.1 ChimeraX-ReadPbonds: 1.0.1 ChimeraX-Registration: 1.1.1 ChimeraX-RemoteControl: 1.0 ChimeraX-RenderByAttr: 1.1 ChimeraX-RenumberResidues: 1.1 ChimeraX-ResidueFit: 1.0.1 ChimeraX-RestServer: 1.1 ChimeraX-RNALayout: 1.0 ChimeraX-RotamerLibMgr: 3.0 ChimeraX-RotamerLibsDunbrack: 2.0 ChimeraX-RotamerLibsDynameomics: 2.0 ChimeraX-RotamerLibsRichardson: 2.0 ChimeraX-SaveCommand: 1.5.1 ChimeraX-SchemeMgr: 1.0 ChimeraX-SDF: 2.0.1 ChimeraX-Segger: 1.0 ChimeraX-Segment: 1.0.1 ChimeraX-SelInspector: 1.0 ChimeraX-SeqView: 2.8.3 ChimeraX-Shape: 1.0.1 ChimeraX-Shell: 1.0.1 ChimeraX-Shortcuts: 1.1.1 ChimeraX-ShowSequences: 1.0.1 ChimeraX-SideView: 1.0.1 ChimeraX-Smiles: 2.1 ChimeraX-SmoothLines: 1.0 ChimeraX-SpaceNavigator: 1.0 ChimeraX-StdCommands: 1.10.3 ChimeraX-STL: 1.0.1 ChimeraX-Storm: 1.0 ChimeraX-StructMeasure: 1.1.2 ChimeraX-Struts: 1.0.1 ChimeraX-Surface: 1.0.1 ChimeraX-SwapAA: 2.0.1 ChimeraX-SwapRes: 2.2.1 ChimeraX-TapeMeasure: 1.0 ChimeraX-Test: 1.0 ChimeraX-Toolbar: 1.1.2 ChimeraX-ToolshedUtils: 1.2.1 ChimeraX-Topography: 1.0 ChimeraX-Tug: 1.0.1 ChimeraX-UI: 1.28.4 ChimeraX-uniprot: 2.2.2 ChimeraX-UnitCell: 1.0.1 ChimeraX-ViewDockX: 1.2 ChimeraX-VIPERdb: 1.0 ChimeraX-Vive: 1.1 ChimeraX-VolumeMenu: 1.0.1 ChimeraX-VTK: 1.0 ChimeraX-WavefrontOBJ: 1.0 ChimeraX-WebCam: 1.0.2 ChimeraX-WebServices: 1.1.1 ChimeraX-Zone: 1.0.1 colorama: 0.4.6 comm: 0.1.3 contourpy: 1.0.7 cxservices: 1.2.2 cycler: 0.11.0 Cython: 0.29.33 debugpy: 1.6.7 decorator: 5.1.1 docutils: 0.19 executing: 1.2.0 filelock: 3.9.0 fonttools: 4.39.3 funcparserlib: 1.0.1 grako: 3.16.5 h5py: 3.8.0 html2text: 2020.1.16 idna: 3.4 ihm: 0.35 imagecodecs: 2022.2.22 imagesize: 1.4.1 importlib-metadata: 6.6.0 ipykernel: 6.21.1 ipython: 8.10.0 ipython-genutils: 0.2.0 ipywidgets: 8.0.6 jedi: 0.18.2 Jinja2: 3.1.2 jupyter-client: 8.0.2 jupyter-core: 5.3.0 jupyterlab-widgets: 3.0.7 kiwisolver: 1.4.4 line-profiler: 4.0.2 lxml: 4.9.2 lz4: 4.3.2 MarkupSafe: 2.1.2 matplotlib: 3.6.3 matplotlib-inline: 0.1.6 msgpack: 1.0.4 nest-asyncio: 1.5.6 netCDF4: 1.6.2 networkx: 2.8.8 nibabel: 5.0.1 nptyping: 2.5.0 numexpr: 2.8.4 numpy: 1.23.5 openvr: 1.23.701 packaging: 21.3 ParmEd: 3.4.3 parso: 0.8.3 pep517: 0.13.0 pexpect: 4.8.0 pickleshare: 0.7.5 Pillow: 9.3.0 pip: 23.0 pkginfo: 1.9.6 platformdirs: 3.5.0 prompt-toolkit: 3.0.38 psutil: 5.9.4 ptyprocess: 0.7.0 pure-eval: 0.2.2 pycollada: 0.7.2 pydicom: 2.3.0 Pygments: 2.14.0 pynrrd: 1.0.0 PyOpenGL: 3.1.5 PyOpenGL-accelerate: 3.1.5 pyparsing: 3.0.9 pyproject-hooks: 1.0.0 PyQt6-commercial: 6.4.2 PyQt6-Qt6: 6.4.3 PyQt6-sip: 13.4.1 PyQt6-WebEngine-commercial: 6.4.0 PyQt6-WebEngine-Qt6: 6.4.3 python-dateutil: 2.8.2 pytz: 2023.3 pyzmq: 25.0.2 qtconsole: 5.4.0 QtPy: 2.3.1 RandomWords: 0.4.0 requests: 2.28.2 scipy: 1.9.3 setuptools: 67.4.0 setuptools-scm: 7.0.5 sfftk-rw: 0.7.3 six: 1.16.0 snowballstemmer: 2.2.0 sortedcontainers: 2.4.0 soupsieve: 2.4.1 sphinx: 6.1.3 sphinx-autodoc-typehints: 1.22 sphinxcontrib-applehelp: 1.0.4 sphinxcontrib-blockdiag: 3.0.0 sphinxcontrib-devhelp: 1.0.2 sphinxcontrib-htmlhelp: 2.0.1 sphinxcontrib-jsmath: 1.0.1 sphinxcontrib-qthelp: 1.0.3 sphinxcontrib-serializinghtml: 1.1.5 stack-data: 0.6.2 tables: 3.7.0 tcia-utils: 1.2.0 tifffile: 2022.10.10 tinyarray: 1.2.4 tomli: 2.0.1 tornado: 6.3.1 traitlets: 5.9.0 typing-extensions: 4.5.0 tzdata: 2023.3 urllib3: 1.26.15 wcwidth: 0.2.6 webcolors: 1.12 wheel: 0.38.4 wheel-filename: 1.4.1 widgetsnbextension: 4.0.7 zipp: 3.15.0
Change History (2)
comment:1 by , 17 months ago
Cc: | added |
---|---|
Component: | Unassigned → Window Toolkit |
Owner: | set to |
Platform: | → all |
Project: | → ChimeraX |
Status: | new → assigned |
Summary: | ChimeraX bug report submission → Crash giving widget focus |
comment:2 by , 17 months ago
Resolution: | → can't reproduce |
---|---|
Status: | assigned → closed |
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