Dear Li(?),
The MolProbity server fixes the atom naming before the actual validation. You can use that. The ATOM/HETATM conversion is not needed, the PDB will do that for you when you deposit your structure model. If you really need it now, I guess it's easy enough to do with you favourite script language. Cheers, Robbie ________________________________ > Date: Tue, 9 Aug 2011 16:48:23 +0900 > From: [email protected] > Subject: [ccp4bb] **Possible spam**How to convert CNS PDB format to the > most current version of the PDB format? > To: [email protected] > > > Dear all, > > > > How to convert CNS pdb format to the most current version of the PDB format? > > > > e.g. "HN" (excluding N-term) in CNS output files should be changed to "H" > > > > And I don't know why the CNS put the N-terminal PCA in the ATOM > catagory. How to change it as HETATM? > > > > Thanks! > > > > College of Pharmacy > Pusan National University > Busan, Korea
