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Examples of predicted spectra from DichroCalc (dotted line), PDB2CD (dot-dash line) and PDBMD2CD (dashed line) plotted against the experimentally determined spectrum (18) (solid line) obtained from the PCDDB (8). Two good PDBMD2CD examples are: (A) human dUTPase (PDB code: 1Q5U) and (B) 3-isopropylmalate dehydrogenase (PDB code: 2Y3Z). Two poorer examples are: (C) Ecotin (PDB code: 1ECZ) and (D) Beta-2-microglobulin (PDB code: 2YXF).
