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. 2014 Jan 27;114(8):4041–4062. doi: 10.1021/cr400641x

Figure 13.

Figure 13

Visualization of hp and re mechanisms for H2 release upon N2 (blue) binding to E4. The following is shown: the Fe-2,3,6,7 face of resting FeMo-co; the structure of FeMo-co must distort in different stages of catalysis. The Fe that binds N2 is presumed to be Fe6, as indicated by studies of α-70Val variants; when bold, red, Fe6 is formally reduced by two equivalents (see text). The bridging hydrides of E4 (green) are positioned to share an Fe “vertex”, as suggested by re mechanism of H2 release upon N2 binding. Alternative binding modes for N2-derived species can be envisaged.