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. 2024 Feb 1;128(6):1333–1349. doi: 10.1021/acs.jpcb.3c06304

Figure 2.

Figure 2

Schematic depiction of direct ammonia interaction modes with the Mn4CaO5 cluster of the OEC: Binding modes A–D involve ammonia coordination on the Mn4 ion, replacing O5 in A, W1 in B and D and W2 in C, while mode E involves ammonia coordination on Mn1.