A, active site of apo-BaP4H structure with no cofactors bound. B, hydrogen bonding interactions of active site residues of apo-BaP4H between protein and water are indicated by black dashes with corresponding distances. The metal binding residues (His127, Asp129, and His193) and residues involved in hydrogen bonds are shown as sticks: carbon (protein backbone color), oxygen (red), nitrogen (blue). The 2Fo − Fc composite omit maps (blue mesh) are contoured at 1.0 σ around the active site residues.