Dear phenix.bb

How do I specifically exclude particular amino acids from torsion-angle ncs?
From the GUI, it is not obvious.

In a couple of my chains, one or two amino acids are in definite crystal contacts, and are therefore in a different rotamer/conformation compared to the other ncs-related copies.  

Unfortunately, I can't seem to find the right option / keyword to stop the refinement job moving these side-chains to agree with the rotamers found in the other molecules of the asymmetric unit. 

Many thanks,

Tony.


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Dr Antony W Oliver

Senior Research Fellow
CR-UK DNA Repair Enzymes Group
Genome Damage and Stability Centre
Science Park Road
University of Sussex
Falmer, Brighton, BN1 9RQ

email: [email protected]
tel (office): +44 (0)1273 678349
tel (lab): +44 (0)1273 677512