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PyDISH No: 12239

PDB: 6ciz,
chainID: A, resSeq: 600
heme type: B

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 2.601 Å

axial ligand #1: CYS

chainID: A,
resSeq: 442,
Coordination distance[Å]: 2.664
molecule: Steroid 17-alpha-hydroxylase/17,20 lyase
EC number: 1.14.14.19,1.14.14.32
Organism: Homo sapiens

axial ligand #2: 3NR

chainID: A,
resSeq: 601,
Coordination distance[Å]: 2.299
molecule: 6-cyano-17-(3-pyridyl)-androst-5,16-dien-3-ol

List of other hemes in pdb:6ciz

ID of heme Distortion Axial ligands on heme Function & structure
6ciz-B-600
sad. -0.14
ruf. +0.43
dom. -0.08
bre. -0.16
CYS chainID: B,
resSeq: 442,
molecule: Steroid 17-alpha-hydroxylase/17,20 lyase
oxidoreductase
oligomeric count: 1
pocket vol.: 416.0 Å3
d(Fe-oop): 0.008 Å
3NR chainID: B, resSeq: 601,
molecule: 6-cyano-17-(3-pyridyl)-androst-5,16-dien-3-ol
6ciz-C-600
sad. -0.04
ruf. +0.52
dom. -0.07
bre. -0.16
CYS chainID: C,
resSeq: 442,
molecule: Steroid 17-alpha-hydroxylase/17,20 lyase
oxidoreductase
oligomeric count: 1
pocket vol.: 423.0 Å3
d(Fe-oop): 0.032 Å
3NR chainID: C, resSeq: 601,
molecule: 6-cyano-17-(3-pyridyl)-androst-5,16-dien-3-ol
6ciz-D-600
sad. -0.11
ruf. +0.24
dom. -0.00
bre. -0.18
CYS chainID: D,
resSeq: 442,
molecule: Steroid 17-alpha-hydroxylase/17,20 lyase
oxidoreductase
oligomeric count: 1
pocket vol.: 417.0 Å3
d(Fe-oop): 0.093 Å
3NR chainID: D, resSeq: 601,
molecule: 6-cyano-17-(3-pyridyl)-androst-5,16-dien-3-ol