Opened 10 years ago

Closed 10 years ago

Last modified 10 years ago

#126 closed defect (fixed)

RNA residues have in_chain false

Reported by: Tom Goddard Owned by: Eric Pettersen
Priority: major Milestone:
Component: Core Version:
Keywords: Cc:
Blocked By: Blocking:
Notify when closed: Platform: all
Project: chimera

Description

Most or all RNA residues have in_chain false. For example

open 1h4s
surf

doesn't surface the RNA chain T because it decides it is not part of a chain (hence considered ligand, solvent, ions). Similar with 1jj2 chain 0 (zero), but in this case a few residues seem to have in_chain True but most are false.

RNA used to be identified correctly, in_chain = True.

Change History (4)

comment:1 by Tom Goddard, 10 years ago

Mysteriously, opening pdb format 1jj2 has this problem, but opening mmCIF format 1jj2 does not show this problem.

comment:2 by Eric Pettersen, 10 years ago

Resolution: fixed
Status: newclosed

comment:3 by Eric Pettersen, 10 years ago

When res names were switched to fixed strings, pdbio::canonicalize_res_name() should have used a reference and didn't, so the "canonicalized" nucleic acid residue names still had their spaces in them, which caused them not to be recognized as polymeric.

comment:4 by Eric Pettersen, 10 years ago

Component: Molecular DataCore
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