On Wed, 2013-05-29 at 13:11 -0400, Heather Condurso wrote:
Dear all,
I have a few related structures that I would like to compare to make figures for publication but I have a few issues. The biggest issue is that my structures are large (12- 422aa chains) and any attempt at simple alignment in pymol results in a crash. I would like to first compare entire structures, but also compare the differences between related chains in the same structure. I want to look at the small differences in the active site density. What is the best way to do this? Is there a simple way to do this or do I need to make separate pdb files for each chain? Can I use the same mtz or should I rename copies?
I will try a few things but any advice would be greatly appreciated. Heather
From what you describe, you need coot - you can show "NCS ghosts" as well as transform maps by NCS.
-- Coot verendus est