Table 6.
Docking result of quercetin against CALHM1.
| S.No | Mode | Affinity (kcal/mol) | Distance From Best Mode RMSD l.b | Distance From Best Mode RMSD u.b |
|---|---|---|---|---|
| 1. | 1 | −12.45 | 0.000 | 0.000 |
| 2. | 2 | −12.34 | 21.115 | 20.357 |
| 3. | 3 | −12.12 | 12.235 | 12.514 |
| 4. | 4 | −11.65 | 9.656 | 6.524 |
| 5. | 5 | −11.25 | 8.459 | 2.722 |
| 6. | 6 | −10.81 | 8.287 | 10.650 |
| 7. | 7 | −9.45 | 7.775 | 1.089 |
| 8. | 8 | −9.32 | 6.002 | 11.924 |
| 9. | 9 | −8.23 | 6.028 | 14.615 |