Table 6.
Prodrugs | Docking Energy (kcal/mol) | Binding Pocket Residues |
---|---|---|
5a | −8.90 | Gln189, His193, Lys197, Leu377, Phe390, Val281, Leu280, val273, Glu276, Gln275, His |
5b | −9.90 | Gln189, His193, Thr192, Ala188, Phe186, Tyr371, Trp373, His374, Leu276, Leu377, Ala429, Val430,Val433, Phe390, Leu394, Val281, Leu280 |
5c | −9.40 | His193, Thr192, Ala188, Phe185, Val277, Lys197, Thr198, His372, Tyr371, His374, Leu377, Ala185 |
Dexibuprofen | −8.60 | Gln189, Phe390, Val281, Leu263, Leu394 and Leu377 |