[phenixbb] refine occupancy of partially overlapping ligands
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?
Chris Ulens, Ph.D.
Lab of Structural Neurobiology
Division of Pharmacology
Campus Gasthuisberg, ON1
Herestraat 49, PB 601
Tel +32 16 345812
Fax +32 16 345699
Telepathy 2.69 GHz
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