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. 2023 Jan 9;16(1):95. doi: 10.3390/ph16010095

Table 1.

Permanence time of hydrogen interactions (Hbond) in the active sites of AChE and BuChE during the production phase and identification of the pairs involved.

AChE
Residue Protein ZINC390718 Permanence (%) Total
Tyr124 OH N1 16.52 39.88
OH N2 23.36
Gln291 NE2 N3 0.57 10.83
O N4 10.26
Ser293 N N3 0.28 55.68
O N4 55.84
Phe295 N O1 86.61 86.61
Arg296 N O1 21.37 21.37
Tyr341 OH N1 4.27 10.53
OH N2 0.85
O N4 5.41
BuChE
Asp70 OD1 N4 37.92 75.17
OD2 N4 37.25
Glu197 OE1 N2 12.42 15.08
OE2 N2 2.66
Tyr332 OH N4 2.88 44.12
OH O1 0.22
OH N1 2.66
OH N2 38.36
Lis339 NZ N3 33.04 33.04