Exploring unconventional approaches to Molecular Replacement in X-ray crystallography with SIMBAD

Adam Simpkin
Molecular replacement (MR) is the most popular technique to solve the phase problem in macromolecular crystallography. The conventional approach to finding search models for MR is to use the sequence of the target structure to identify a suitable homologue. This approach is based on the assumption that sequence similarity is a useful guide to structural similarity. Whilst largely true, this strategy is not always effective. For example, when a contaminant protein has been crystallised or...
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