Ligand | H-Bonding | Hydrophobic Interaction | MolDock Score |
LasR enzyme natural ligand | Trp60, Tyr56, Thr75, Ser129, Asp73 | Ala50, Ala105, Cys79, Gly38, Ile52, Leu36, Leu39, Leu40, Leu110, Phe51, Phe101, Thr80, Thr115, Trp88, Tyr47, Tyr64, Tyr93, Val76, Ala127, Gly126, Leu125 | −134.274 |
Febuxostat | Arg61, Tyr56, Leu125 | Gly38, Leu36, Leu39, Leu40, Leu110, Phe101, Thr75, Thr115, Trp60, Trp88, Tyr47, Tyr64, Tyr93, Val76, Ala127, Gly126, Ser129 | −133.876 |