On 05/11/11 11:00, [log in to unmask] wrote:
> Dear Madhavi,
> How did you generate the cif file? Did you make sure that CL1 and CL2 are defined as atom.type_symbol CL and not C? If you used e.g. prodrg with your old file with old positions of the CL atoms, prodrg will have generated a cif file with atom types C instead of CL.
> Herman
The residue name is MK5, which is not included in the CCP4 distribution,
so the dictionary entry must have been custom created.
--
=======================================================================
All Things Serve the Beam
=======================================================================
David J. Schuller
modern man in a post-modern world
MacCHESS, Cornell University
[log in to unmask]
|