Table 1.

Binding energy of luteolin-AerA complex calculated by MM-GBSA method

Contribution	Energy (kcal/mol)
∆Evdw	−21.86 ± 0.35
∆Eele	−25.63 ± 0.75
∆Gpolar	39.01 ± 0.61
∆Gnonpolar	−3.34 ± 0.03
∆Gtotal	−11.82 ± 0.33