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. Author manuscript; available in PMC: 2021 Aug 12.
Published in final edited form as: Chem Rev. 2020 Jun 29;120(15):7152–7218. doi: 10.1021/acs.chemrev.9b00813

Figure 18.

Figure 18.

(a) Protein structures obtained from MD simulation of native MbCO in (a) and the double mutant MbCO in (b). The double mutant has two substituted residues of Arg67 (R67) and Asp92 (D92) instead of Thr67 (T67) and Ser92 (S92) in the wild type. The numerically calculated IR spectra of the CO stretch mode (solid red line) of native MbCO in (c) and the double mutant in (d) are displayed with the experimental results (blue dashed line). Reproduced from Figures 4 and 9 of Ref.360. Copyright 2013 The American Chemical Society.