Re: [COOT] symmetry operator generation on COOT

2009-05-22 Thread Paul Emsley
For the record/archive I'd like to conclude this thread. It recognizes the spacegroup as P 1 21/c 1. Is seems that Coot indeed does display symmetry correctly for this spacegroup, but not in the way that other programs (e.g. Mercury or Swiss PDB Viewer) do. coot (show-spacegroup 0) P

[COOT] symmetry operator generation on COOT

2009-05-21 Thread doebbler
Hi all, I am running Coot 0.5.2 on an intel Mac 10.5.6. I am trying to visualize the symmetry related molecules for a small inorganic molecule in spacegroup P 21/C. If I load the file into swiss PDB viewer or Mercury, the symmetry operators show that I have 4 molecules in my unit cell and

Re: [COOT] symmetry operator generation on COOT

2009-05-21 Thread Paul Emsley
Hi Jennifer, Doebbler wrote: I am running Coot 0.5.2 on an intel Mac 10.5.6. I am trying to visualize the symmetry related molecules for a small inorganic molecule in spacegroup P 21/C. If I load the file into swiss PDB viewer or Mercury, the symmetry operators show that I have 4