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Computational Chemistry and Biology Core Facility

X-ray Crystallography


The CCB Core can assist in the interpretation of complex data sets resulting from X-ray crystallography experiments, including:

  • Building and refining structural models of proteins or protein-ligand complexes
  • Generating and visualizing electron density maps
  • Full refinement and minimization of X-ray structures
  • Automatic fitting of ligands into available density
  • Validation of crystal structures utilizing various test criteria