Table 3.
Dock scores and MMGBSA binding energy for the interaction of the ligands with p53 and Mortalin.
| Natural metabolites |
Wi-N |
Wi-A |
Cuc-B |
CAPE |
ARC |
|||||
|---|---|---|---|---|---|---|---|---|---|---|
| Interactions | Mortalin | p53 | Mortalin | p53 | Mortalin | p53 | Mortalin | p53 | Mortalin | p53 |
| Docking score | -2.623 | -4.30 | -2.792 | -2.30 | -5.541 | -4.604 | -3.202 | -3.364 | 0.110 | -0.886 |
| MMGBSA Binding energy |
-75.43 kcal/mol | No Stable Interaction |
-80.57 Kcal/mol |
No Stable Interaction | -55.52 Kcal/mol |
-59.56 Kcal/mol |
-51.57 Kcal/mol |
No Stable Interaction | -43.12 Kcal/mol |
-53.82 Kcal/mol |