[gmx-users] pdb2gmx and protein DNA complexes
Debojyoti Dutta
ddutta at usc.edu
Wed Nov 8 18:08:21 CET 2006
Hi
I am trying to simulate a protein DNA complex but I am stuck at the pdb2gmx
stage as it gets stuck when it encounters a nucleotide.
Program pdb2gmx, VERSION 3.3
Source code file: resall.c, line: 438
Fatal error:
Residue 'C' not found in residue topology database
The pdb segment is as follows:
ATOM 1239 NZ LYS B 513 -24.159 16.372 -25.774 1.00 51.42
N
ATOM 1249 N1 C C 1 -10.253 8.018 40.704 1.00 25.86
N
Has anyone encountered this problem before?
Regards
Debo
--
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Debojyoti Dutta, PhD (USC)
http://catarina.usc.edu/~ddutta
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