From: Pascal A. <p.a...@ib...> - 2011-05-17 17:44:31
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Hi Jason, A more difficult one (at least for me) Pymol seems to write (through save command) nucleic acid residue names not as suggested by PDB convention. Here is an extract of a PDB file (any PDB file containing nucleic acid residues shows the same try 100D for example) ATOM 1 O5' C A 1 -4.549 5.095 4.262 1.00 28.71 O ATOM 2 C5' C A 1 -4.176 6.323 3.646 1.00 27.35 C ATOM 3 C4' C A 1 -3.853 7.410 4.672 1.00 24.41 C When I save this file (save command in pymol) i get this Output from pymol XXXXX (this is added by me) ATOM 1 O5' C A 1 -4.549 5.095 4.262 1.00 28.71 O ATOM 2 C5' C A 1 -4.176 6.323 3.646 1.00 27.35 C ATOM 3 C4' C A 1 -3.853 7.410 4.672 1.00 24.41 C In one instance, the "C" residue name is left justified and right justified in the other. Of course, this cannot happen for the three letter residue names. Any clue ? I tried the following : pdb_truncate_residue_name (boolean, default: off) controls whether or not PDB residue names are truncated to three letters only. with no effect Thanks for help Pascal ________________________ |