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. 2021 Jan 27;11(2):169. doi: 10.3390/biom11020169

Figure 7.

Figure 7

Docking results reflecting the behavior of the created sarin-HI-6 and tabun-HI-6 conglomerates (green) after reactivation of the active sites of AChE and BuChE (gray). The key amino acids involved in the interactions with the OP-reactivator conglomerate are marked with yellow sticks. The postreactivation complex binds more strongly at the active site of BuChE than AChE.