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PyDISH No: 09275

PDB: 4nkv,
chainID: A, resSeq: 600
heme type: B

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 2.646 Å

axial ligand #1: CYS

chainID: A,
resSeq: 442,
Coordination distance[Å]: 2.582
molecule: Steroid 17-alpha-hydroxylase/17,20 lyase
EC number: 1.14.99.9, 4.1.2.30
Organism: Homo sapiens

axial ligand #2: AER

chainID: A,
resSeq: 601,
Coordination distance[Å]: 2.403
molecule: Abiraterone

List of other hemes in pdb:4nkv

ID of heme	Distortion	Axial ligands on heme		Function & structure
4nkv-B-600	`sad. -0.10 ruf. +0.39 dom. -0.21 bre. -0.04`	CYS	chainID: B, resSeq: 442, molecule: Steroid 17-alpha-hydroxylase/17,20 lyase	oxidoreductase oligomeric count: 1 pocket vol.: 421.0 Å³ d(Fe-oop): 0.000 Å
4nkv-B-600	`sad. -0.10 ruf. +0.39 dom. -0.21 bre. -0.04`	AER	chainID: B, resSeq: 601, molecule: Abiraterone
4nkv-C-600	`sad. -0.10 ruf. +0.43 dom. -0.15 bre. -0.03`	CYS	chainID: C, resSeq: 442, molecule: Steroid 17-alpha-hydroxylase/17,20 lyase	oxidoreductase oligomeric count: 1 pocket vol.: 434.0 Å³ d(Fe-oop): 0.024 Å
4nkv-C-600	`sad. -0.10 ruf. +0.43 dom. -0.15 bre. -0.03`	AER	chainID: C, resSeq: 601, molecule: Abiraterone
4nkv-D-600	`sad. -0.08 ruf. +0.42 dom. -0.08 bre. -0.02`	CYS	chainID: D, resSeq: 442, molecule: Steroid 17-alpha-hydroxylase/17,20 lyase	oxidoreductase oligomeric count: 1 pocket vol.: 423.0 Å³ d(Fe-oop): 0.149 Å
4nkv-D-600	`sad. -0.08 ruf. +0.42 dom. -0.08 bre. -0.02`	AER	chainID: D, resSeq: 601, molecule: Abiraterone