[phenixbb] ambiguous ligand density
Pompeu,Yuri Alexey Andreiw
yuri.pompeu at ufl.edu
Wed Mar 9 08:17:45 PST 2011
I have this strucuture I solved by Molecular replacement. It is a
single mutant of previously solved enzyme. I started refining it and
fit the ligand in a way that gives me the experimental stereochemistry.
The final map 2mFo-2DFc looks great. After further examination I
noticed, I have a carbonyl that does not seem to be bound to anything
I started looking at my average kick and SA composit omit-map prior to
modeling in the ligand and now I am really lost.
Could anyone help?
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