Table 3. Binding Affinities of Docking Complexes and Their Interacting Residues.
binding
affinities (kcal/mol) |
|||
---|---|---|---|
sl. no. | ligands | AKT1 | EGFR |
01 | aurantiamide | –7.8 | –6.9 |
02 | β-sitosterol | –8.5 | –8.6 |
03 | campesterol | –8.7 | –8.7 |
04 | clionasterol | –8.3 | –8.6 |
05 | kaempherol | –7.6 | –7.8 |
06 | squalene | –5.9 | –4.5 |
07 | stigmasterol | –9 | –9.2 |
08 | diisooctyl phthalate | –6.3 | –5.9 |
09 | 2-monoolein | –5.4 | –5.2 |