Table 7.
Polarized curvatures as binding indicators of protein surfaces. Maximal curvature (κ1), minimal curvature (κ2), positive electrostatic surface potential (Φ+) and negative electrostatic surface potential (Φ−) are combined to indicate potential binding sites.
κ1 > 0 | κ2 < 0 | |
---|---|---|
Φ+ > 0 | site for negatively charged protein | site for negatively charged small ligand |
Φ− < 0 | site for positively charged protein | site for positively charged small ligand |