I got a symmetry-related molecule in the ASU (mine was about 400 A off the origin) and ran areaimol and the PDBe PISA server, and it worked on both! Got all the same contacts as my DIFFMODE COMPARE run. Thanks Paul!
-Phillip ________________________________ From: CCP4 bulletin board <CCP4BB@JISCMAIL.AC.UK> on behalf of Paul Emsley <pems...@mrc-lmb.cam.ac.uk> Sent: Wednesday, October 11, 2017 12:07:33 PM To: CCP4BB@JISCMAIL.AC.UK Subject: Re: [ccp4bb] areaimol missing symmetry mates Try moving your molecule closer to the origin, by unit cell shift or choosing a symmetry-related molecule. (In Coot, you can do this by using Extensions -> Modelling -> Symm Shift Reference Chain Here. Paul.
