Table 1 Potential RPO inhibitors selected from the Kegg, PubChem and Zinc databases used in docking studies
Molecule | Affinity (kcal/mol) | H-bond donor | H-bond acceptor |
|---|---|---|---|
Rifampicin | -10.4 | 6 | 15 |
Rifapentine | -9 | 6 | 15 |
Rifabutin Mycobutin | -8 | 5 | 14 |
Zinc5220312 | -5.2 | 5 | 7 |
Zinc5124992 | -5 | 2 | 8 |
Zinc5220316 | -4.7 | 5 | 7 |
Zinc5220339 | -5.1 | 5 | 7 |
Zinc22173122 | -5.5 | 4 | 4 |