Table 1 Molecular docking results and interaction of Moringa oleifera compounds with CDK2 protein
Ligand | Name | Binding affinity | Glide Energy | XP- H bond | Glide-ligand efficiency |
|---|---|---|---|---|---|
Reference | Dinaciclib | -5.445 | -43.761 | -0.785 | -0.188 |
1 | Chlorogenic acid | -9.119 | -53.061 | -3.335 | -0.365 |
2 | Quercetin | -7.501 | -47.010 | -1.830 | -0.339 |
3 | Ellagic acid | -7.138 | -45.633 | -1.920 | -0.321 |
4 | Niazirin | -6.835 | -43.100 | -1.938 | -0.342 |
5 | Kaempferol | -6.717 | -43.901 | -1.482 | -0.318 |