Regarding suggestions that the pdb or the IUCR to tell us what to do:

IMO -

Neither of the usual solutions - (a) deleting side chains when there is no 
density or (b) letting B factors go where they will - is without problems (this 
is clear from the ongoing discussion).  I would be really unhappy if some 
authority unilaterally imposed either of these solutions on the protein 
crystallographic community.

Sue


Dr. Sue A. Roberts
Dept. of Chemistry and Biochemistry
University of Arizona
1041 E. Lowell St.,  Tucson, AZ 85721
Phone: 520 621 8171
s...@email.arizona.edu
http://www.biochem.arizona.edu/xray









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