Iron in PDB 8w72: Crystal Structure of A P450 Enzyme Dmlh That Catalyze Intramolecular Phenol Coupling in the Biosynthesis of Cihanmycins

The structure of Crystal Structure of A P450 Enzyme Dmlh That Catalyze Intramolecular Phenol Coupling in the Biosynthesis of Cihanmycins, PDB code: 8w72 was solved by C.Fang, L.Zhang, Y.Zhu, C.Zhang, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	50.22 / 3.25
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	36.333, 100.44, 106.97, 90, 90, 90
R / Rfree (%)	20.3 / 30.3

The binding sites of Iron atom in the Crystal Structure of A P450 Enzyme Dmlh That Catalyze Intramolecular Phenol Coupling in the Biosynthesis of Cihanmycins (pdb code 8w72). This binding sites where shown within 5.0 Angstroms radius around Iron atom.
In total only one binding site of Iron was determined in the Crystal Structure of A P450 Enzyme Dmlh That Catalyze Intramolecular Phenol Coupling in the Biosynthesis of Cihanmycins, PDB code: 8w72:

Iron binding site 1 out of 1 in the Crystal Structure of A P450 Enzyme Dmlh That Catalyze Intramolecular Phenol Coupling in the Biosynthesis of Cihanmycins


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 1 of Crystal Structure of A P450 Enzyme Dmlh That Catalyze Intramolecular Phenol Coupling in the Biosynthesis of Cihanmycins within 5.0Å range: probe atom residue distance (Å) B Occ A:Fe501 b:40.4 occ:1.00 FE A:HEM501 0.0 40.4 1.0 NA A:HEM501 1.9 42.1 1.0 NB A:HEM501 2.0 43.0 1.0 ND A:HEM501 2.1 38.0 1.0 NC A:HEM501 2.2 46.9 1.0 SG A:CYS357 2.3 44.9 1.0 C4A A:HEM501 2.9 49.3 1.0 C1A A:HEM501 2.9 40.9 1.0 C4B A:HEM501 3.0 53.2 1.0 C1B A:HEM501 3.0 50.9 1.0 C4D A:HEM501 3.1 43.2 1.0 C1C A:HEM501 3.1 44.3 1.0 C1D A:HEM501 3.2 40.4 1.0 C4C A:HEM501 3.2 44.3 1.0 CB A:CYS357 3.3 34.8 1.0 CHA A:HEM501 3.3 46.7 1.0 CHB A:HEM501 3.4 49.2 1.0 CHC A:HEM501 3.4 52.5 1.0 CHD A:HEM501 3.6 42.9 1.0 CA A:CYS357 4.0 38.0 1.0 C3A A:HEM501 4.1 46.3 1.0 C2A A:HEM501 4.1 40.2 1.0 C3B A:HEM501 4.2 49.3 1.0 C2B A:HEM501 4.3 50.1 1.0 C3D A:HEM501 4.3 32.7 1.0 C2D A:HEM501 4.3 33.8 1.0 C2C A:HEM501 4.4 44.1 1.0 C3C A:HEM501 4.4 47.5 1.0 N A:CYS357 4.9 42.8 1.0 C A:CYS357 5.0 44.9 1.0

C.Fang, L.Zhang, Y.Zhu, C.Zhang. Crystal Structure of A P450 Enzyme Dmlh That Catalyze Intramolecular Phenol Coupling in the Biosynthesis of Cihanmycins To Be Published.