[phenixbb] refine occupancy of partially overlapping ligands

Chris Ulens chris.ulens at med.kuleuven.be
Tue Jul 14 10:45:33 PDT 2009

I'm trying to refine the occupancy of 2 ligands that occupy the same  
binding pocket in 2 *partially* overlapping orientations. Let's assume  
I would define the ligands in 2 separate "chains" termed A and B.  
Could the experts point me to the proper syntax to define the correct  
group restraints to refine the occupancy?

Thank you.

Chris Ulens, Ph.D.
Lab of Structural Neurobiology
Division of Pharmacology
Campus Gasthuisberg, ON1
Herestraat 49, PB 601
B-3000 Leuven
Tel +32 16 345812
Fax +32 16 345699
Telepathy 2.69 GHz

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