Table 2. Theoretical (docking) binding energies for vitamin D3 at the interfacial-binding site (site B) of dimeric 2BLG.
Receptor | Binding energy for Vitamin D3 (kcal mol-1) |
---|---|
Rigid Dimer | -8.0 |
Flexible Dimer (half interface) | -8.1 |
Flexible Dimer (full interface) | -8.8 |