Dear Sozanne, B-factors mimic a weighting factor. When they are high, high resolution reflections are weighted down. You may either not worry about the B-factors (I don't look at them because refinement program know what they are doing) or cut-back your resolution to I/sigma(I)=2. The latter will sooth old-fashioned reviewers, the formar will be modern crystallography. Best, Tim On Friday, July 12, 2019 5:09:27 PM CEST ssolmaz wrote:
Dear Kay, Thank you, this is helpful. Yes, the data were collected at the synchrotron with a Dectris Pilatus 6MF detector. CC1/2 at the highest resolution shell (2.55A - 2.5A) is 0.481 and I/sigma(I) is 1.2. The multiplicity is 9.7. Best, Sozanne.
Sozanne Solmaz, Ph. D. Assistant Professor of Biological Chemistry Department of Chemistry, State University of New York at Binghamton PO Box 6000, Binghamton, NY 13902 Office: Smart Energy Building Room SN1045 25 Murray Hill Road, Vestal, NY, 13850 http://chemiris.chem.binghamton.edu/SOLMAZ/solmaz.html
-- -- Tim Gruene Head of the Centre for X-ray Structure Analysis Faculty of Chemistry University of Vienna Phone: +43-1-4277-70202 GPG Key ID = A46BEE1A