Table 1 Summary of the best docked compounds for Site-1 and Site-2.
Compound | Name | Site | Cluster size | Average energy (kcal/mol) | Lowest energy (kcal/mol) |
|---|---|---|---|---|---|
Novobiocin | Novobiocin | 1 | 81 | −8.75 | −8.97 |
SANC309 | 3′-Bromorubrolide F | 2 | 79 | −9.13 | −9.20 |
SANC491 | Cephalostatin 17 | 1 | 93 | −11.41 | −11.44 |
SANC518 | 20(29)-Lupene-3β-isoferulate | 1 | 84 | −11.03 | −11.46 |
