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. 2019 Nov 19;9:17096. doi: 10.1038/s41598-019-52764-8

Table 13.

Binding affinities and Inhibition constant (T = 298.15 K) of Synthetic Acceptor Substrates.

Compounds Binding energy (kcal/mol) Inhibition constant, µM
Natural substrate −6.63 ± 0.02 14
53 −6.16 ± 0.03 30
54 −6.11 ± 0.03 33
55 −6.24 ± 0.04 26
56 −6.19 ± 0.04 29