| Binding energy (KJ/mol) | Polar contact | Interacting Residue |
Ligand L | −6.2 | DC5, DG18 | DC5, DT17, DG18, DT19 |
Compound 1 | −6.8 | DG2, DA4 | DG2, DG3, DA4, DC5, DC20, DC21 |
Compound 2 | −6.8 | DG2, DA4 | DG2, DG3, DA4, DC5, DC20, DC21 |
Compound 3 | −7.5 | DG2, DA4 | DG2, DG3, DA4, DC5, DC20, DC21, DG22 |
Compound 4 | −6.6 | - | DC5, DA6, DT17, DG18, DT19 |