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