[ccp4bb] how to apply non-protein crystallographic symmetry

2014-07-14 Thread Richard Gillilan
I have a pdb file for a non-protein having C 1 2/c symmetry. PyMol can't recognize the spacegroup. Can someone recommend software that can apply the crystallographic symmetry to give the full structure? Richard Gillilan MacCHESS Cornell University

Re: [ccp4bb] how to apply non-protein crystallographic symmetry

2014-07-14 Thread Tim Gruene
Dear Richard, Coot shouldn't have an issue with non-Sohnke space groups. I used it to build a structure in P-1. If you want to edit the molecule, you could also try ShelXle, available at http://ewald.ac.chemie.uni-goettingen.de/shelx/eingabe.php. Best, Tim On 07/14/2014 10:26 PM, Richard

Re: [ccp4bb] how to apply non-protein crystallographic symmetry

2014-07-14 Thread Richard Gillilan
Thanks to all who responded so quickly! Coot worked. Richard On Jul 14, 2014, at 4:33 PM, Tim Gruene wrote: Dear Richard, Coot shouldn't have an issue with non-Sohnke space groups. I used it to build a structure in P-1. If you want to edit the molecule, you could also try ShelXle,