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. 2023 May 24;9(6):e16222. doi: 10.1016/j.heliyon.2023.e16222

Table 2.

Binding affinity against bacteria.

Ligand No Histoplasma capsulatum (2jv7) E.coli(6ch3) Salmonella typhi (1wvg) Shigellaflexneria (1z67) Staphylococcus-aureus (3ip4) Staphylococcus hominis(6exs) Cryptococcus neoformans (5xu6)
THS1 −6.0 −6.3 −8.1 −6.3 −5.6 −7.6 −6.0
THS2 −6.6 −7.0 −8.8 −5.8 −6.0 −6.7 −7.2
THS3 −6.5 −6.6 −8.4 −5.5 −5.9 −6.4 −6.3
THS4 −6.2 −6.5 −8.4 −5.5 −6.3 −6.5 −6.7
THS5 −6.6 −6.4 −8.0 −5.5 −5.5 −7.7 −6.0
Ampicillin −6.7 −7.3 −8.7 −7.2 −6.7 −7.8 −7.3
Starting −5.0 −5.1 −6.0 −5.2 −5.7 −6.1 −6.3