TABLE 1.
Ligand docking summary into CeBGlu1 AlphaFold model.
| Ligand | Chosen pose affinity (kcal/mol) | Best pose affinity (kcal/mol) | Rank of chosen pose |
| Gentiopicrin | −9.561 | −9.561 | 1 |
| Swertiamarin | −9.105 | −9.169 | 2 |
| Sweroside | −9.359 | −9.644 | 3 |
Ligand docking summary into CeBGlu1 AlphaFold model.
| Ligand | Chosen pose affinity (kcal/mol) | Best pose affinity (kcal/mol) | Rank of chosen pose |
| Gentiopicrin | −9.561 | −9.561 | 1 |
| Swertiamarin | −9.105 | −9.169 | 2 |
| Sweroside | −9.359 | −9.644 | 3 |