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. Author manuscript; available in PMC: 2021 Feb 26.
Published in final edited form as: Inorg Chem. 2017 Jun 7;56(12):6830–6837. doi: 10.1021/acs.inorgchem.7b00028

Figure 4.

Figure 4.

Normal mode depictions for vibrational Bands A-D in the Rc XHD Mo(IV)-2,4-TV enzyme-product intermediate. The dithiolene S donors are labeled S1 and S2, the sulfhydryl S donor is labeled as S3, and the O of the bound product as OProduct. These vibrations are displayed as a superposition of the maximum and minimum normal mode displacements. The molecular orientations are directed looking down the Mo≡O bond, and this is the z-axis.