Table 1. Docking parameters of verapamil and secoisolariciresinol (SECO) into P-glycoprotein substrate-binding site.
Ligand | MolDock score | Rerank score | H-Bond score | |
---|---|---|---|---|
Docking into the substrate-binding site | Verapamil | −133.3 | −67.9 | −2.7 |
SECO | −123.2 | −96.7 | −2.0 |