Iron in PDB 5jl6: Human Placental Aromatase Cytochrome P450 (CYP19A1): Androstenedione Complex #2

All present enzymatic activity of Human Placental Aromatase Cytochrome P450 (CYP19A1): Androstenedione Complex #2:
1.14.14.14;

The structure of Human Placental Aromatase Cytochrome P450 (CYP19A1): Androstenedione Complex #2, PDB code: 5jl6 was solved by D.Ghosh, J.Lo, C.Egbuta, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	29.90 / 3.00
Space group	P 32 2 1
Cell size a, b, c (Å), α, β, γ (°)	140.314, 140.314, 118.403, 90.00, 90.00, 120.00
R / Rfree (%)	19.5 / 21.7

The binding sites of Iron atom in the Human Placental Aromatase Cytochrome P450 (CYP19A1): Androstenedione Complex #2 (pdb code 5jl6). 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 Human Placental Aromatase Cytochrome P450 (CYP19A1): Androstenedione Complex #2, PDB code: 5jl6:

Iron binding site 1 out of 1 in the Human Placental Aromatase Cytochrome P450 (CYP19A1): Androstenedione Complex #2


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 1 of Human Placental Aromatase Cytochrome P450 (CYP19A1): Androstenedione Complex #2 within 5.0Å range: probe atom residue distance (Å) B Occ A:Fe600 b:72.8 occ:1.00 FE A:HEM600 0.0 72.8 1.0 ND A:HEM600 1.9 73.6 1.0 NA A:HEM600 2.0 68.0 1.0 NB A:HEM600 2.1 68.7 1.0 NC A:HEM600 2.1 72.1 1.0 SG A:CYS437 2.4 66.9 1.0 C1D A:HEM600 2.9 68.4 1.0 C4D A:HEM600 2.9 73.2 1.0 C1A A:HEM600 3.0 70.6 1.0 C4A A:HEM600 3.0 67.5 1.0 C4B A:HEM600 3.0 70.9 1.0 C1B A:HEM600 3.0 69.1 1.0 C4C A:HEM600 3.1 71.6 1.0 C1C A:HEM600 3.1 71.5 1.0 CHA A:HEM600 3.4 70.9 1.0 CHD A:HEM600 3.4 69.0 1.0 CHB A:HEM600 3.4 66.7 1.0 CHC A:HEM600 3.4 70.2 1.0 CB A:CYS437 3.6 73.3 1.0 C19 A:ASD601 3.8 69.9 1.0 C2D A:HEM600 4.2 67.8 1.0 C3D A:HEM600 4.2 70.3 1.0 C2A A:HEM600 4.2 72.4 1.0 C3A A:HEM600 4.2 69.5 1.0 C2B A:HEM600 4.3 69.9 1.0 C3B A:HEM600 4.3 74.1 1.0 C2C A:HEM600 4.3 73.6 1.0 C3C A:HEM600 4.3 75.2 1.0 CA A:CYS437 4.3 74.1 1.0 C1 A:ASD601 4.5 75.7 1.0 C2 A:ASD601 4.8 75.6 1.0 N A:GLY439 4.8 75.4 1.0 C10 A:ASD601 4.8 72.5 1.0 N A:ALA438 4.9 73.7 1.0 C A:CYS437 5.0 72.8 1.0

D.Ghosh, C.Egbuta, J.Lo. Testosterone Complex and Non-Steroidal Ligands of Human Aromatase. J. Steroid Biochem. Mol. 2018BIOL..
ISSN: ISSN 1879-1220
PubMed: 29476820
DOI: 10.1016/J.JSBMB.2018.02.009