Table 10.
Name of the compound | Binding affinity (kJ/mol) | Hydrogen bonds | Electrostatic bonds | Hydrophobic bonds |
|
---|---|---|---|---|---|
Pi-Alkyl | Alkyl | ||||
Doripenem | –9.2 | THR 170 (2.16), THR 170 (2.25), LEU 164 (2.61), VAL 155 (2.65), VAL 155 (1.83), VAL 155 (2.32), THR 156 (3.62), THR 158 (3.53), VAL 157 (3.52) | – | – | – |
Diazepam | –6.7 | ARG 45 (2.50), ARG 45 (3.05), ALA 106 (3.49) | ARG 45 (4.40) | ARG 45 (4.24) | ALA 110 (3.74) |