On Mar 7, 2006, at 10:01 AM, Elaine Meng wrote:

Issue (2) can be even more taxing. IF the cofactor residue has the  

same name and its atoms have the same names and are in the same  

orders in all pairs of structures to be compared, you could then use  

EnsembleMatch.  You'd specify the cofactor residue as the atoms to  

match, e.g.

    :fad

(residues named FAD).  Another approach in this situation would be to  

use the match command, e.g.

    command> match #1:fad #0:fad


As of Chimera 1.2184 and later, the restrictions aren't quite as onerous as Elaine outlined.  The atom names still do have to correspond, but the atoms need not all be in the same order inside the residue.

--Eric

                        Eric Pettersen
                        UCSF Computer Graphics Lab
                        pett@cgl.ucsf.edu
                        http://www.cgl.ucsf.edu