Opened 6 years ago

Closed 6 years ago

#2641 closed defect (fixed)

Rotamers assigns bfactor zero when >1 rotamer incorporated

Reported by: Elaine Meng Owned by: Eric Pettersen
Priority: moderate Milestone:
Component: Structure Editing Version:
Keywords: Cc:
Blocked By: Blocking:
Notify when closed: Platform: all
Project: ChimeraX

Description

I was going through the tutorial and noticed my bfactor coloring was totally off. Eventually realized it was because I had incorporated more than one rotamer at one position, and the altloc B rotamer got assigned bfactors of zero which messed up the range. I think the altloc A rotamer is getting the values it's supposed to (highest value in original residue).

I attached example PDB saved after TYR 41 in chain A was replaced with two rotamers using the Rotamers tool.

Attachments (1)

test.pdb​ (192.6 KB ) - added by Elaine Meng 6 years ago.

Download all attachments as: .zip

Change History (3)

by Elaine Meng, 6 years ago

Attachment: test.pdb​ added

in reply to:  2 comment:1 by Elaine Meng, 6 years ago 

an aside: this would have been a lot easier to discern if I could (a) label by attribute value, and (b) display multiple altlocs!

comment:2 by Eric Pettersen, 6 years ago

Resolution: → fixed
Status: assigned → closed
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