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. 2018 Apr 4;5(4):171750. doi: 10.1098/rsos.171750

Table 4.

Molecular docking analysis of selected compounds.

protein target compound name amino acids involved in intermolecular interactions binding energy (kcal mol−1)
1ZID compound 6f Thr196 −7.826
Phe149
compound 6h Met98 −9.189
Arg32
compound 6s Asp64 −11.123
Trp222
Tyr158
compound 6o Thr196 −7.316