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Table 3 Docking interactions of selected lead compounds

From: In-silico and in-vitro analysis of novel substituted benzimidazolyl derivatives for antimycobacterial potentials targeting enoyl acyl carrier protein reductase (InhA)

Compound

H-Bond

Pi-Pi stacking

4

ILE 194, LYS 165

PHE 149

5a

ILE 194

NIL

5b

ILE 194, TYR 158

NIL

5c

ILE 194, TYR 158

NIL

5d

LYS 165

NIL

5e

TYR 158

NIL

5f

ILE 194, TYR 158

NIL

INH

TYR 158

NIL

  1. According to previous literature four amino acid interactions namely TYR 158, ILE 194, PHE 149 and LYS 165 are crucial for InhA inhibitory activity [29,30,31]