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PyDISH No: 11621

PDB: 5uys,
chainID: C, resSeq: 600
heme type: B

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 2.392 Å

axial ligand #1: CYS

chainID: C,
resSeq: 442,
Coordination distance[Å]: 2.469
molecule: Steroid 17-alpha-hydroxylase/17,20 lyase
EC number: 1.14.14.19,1.14.14.32
Organism: Homo sapiens

axial ligand #2: 8QD

chainID: C,
resSeq: 601,
Coordination distance[Å]: 2.297
molecule: (3alpha,5alpha,8alpha)-17-(pyridin-3-yl)androst-16-en-3-ol

List of other hemes in pdb:5uys

ID of heme Distortion Axial ligands on heme Function & structure
5uys-A-600
sad. -0.18
ruf. +0.45
dom. -0.20
bre. -0.16
CYS chainID: A,
resSeq: 442,
molecule: Steroid 17-alpha-hydroxylase/17,20 lyase
oxidoreductase
oligomeric count: 1
pocket vol.: 422.0 Å3
d(Fe-oop): 0.068 Å
8QD chainID: A, resSeq: 601,
molecule: (3alpha,5alpha,8alpha)-17-(pyridin-3-yl)androst-16-en-3-ol
5uys-B-600
sad. -0.22
ruf. +0.35
dom. -0.11
bre. -0.17
CYS chainID: B,
resSeq: 442,
molecule: Steroid 17-alpha-hydroxylase/17,20 lyase
oxidoreductase
oligomeric count: 1
pocket vol.: 410.0 Å3
d(Fe-oop): 0.075 Å
8QD chainID: B, resSeq: 601,
molecule: (3alpha,5alpha,8alpha)-17-(pyridin-3-yl)androst-16-en-3-ol
5uys-D-600
sad. -0.12
ruf. +0.29
dom. -0.08
bre. -0.21
CYS chainID: D,
resSeq: 442,
molecule: Steroid 17-alpha-hydroxylase/17,20 lyase
oxidoreductase
oligomeric count: 1
pocket vol.: 420.0 Å3
d(Fe-oop): 0.127 Å
8QD chainID: D, resSeq: 601,
molecule: (3alpha,5alpha,8alpha)-17-(pyridin-3-yl)androst-16-en-3-ol