Table 1. Calculated free energies of binding to RiBU by riboflavin and roseoflavin. The contribution of entropy is neglected.
| ligand | ΔEes | ΔGPB | Δ (Ees + GPB) | ΔEvdW |
|---|---|---|---|---|
| riboflavin | −17.5 | 39.5 | 22.0 | −47.8 |
| roseoflavin | −10.7 | 36.9 | 26.3 | −59.3 |
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