Dear users, The native structure for a protein is available and there is a ligand bound data. The crystallisation condition has anomalous scattering metal ions (Cd). Both the data are scaled by separating anomalous pairs. So while refining a ligand bound data with a solution obtained using Molecular replacement, is it recommended to refine using "SAD data directly" in refmac so that the anomalous atoms can be occupancy refined?
Thanking you Regards Kavya -- This message has been scanned for viruses and dangerous content by MailScanner, and is believed to be clean.
