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