Table 2.
Binding affinity and hydrogen bond in complex superoxide dismutase-compounds
| Ligand | Binding affinity (kcal/mol) | Residues binding at ligand-protein complex | |
|---|---|---|---|
|
| |||
| Hydrogen interaction | Hydrophobic interaction | ||
| Ursolic acid | −5.4 | Glu100 | Lys30, Lys23, Lys3 |
| Quercetin | −5.2 | Glu21, Glu100, Lys23 | Thr2, Gln22, Lys30, Val29 |
| Naphthalene-catechol | −7.1 | Glu100, Pro28, Lys23 | Glu21, Trp32 |