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PyDISH No: 09401

PDB: 4pk6,
chainID: A, resSeq: 501
heme type: B

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 3.45 Å

axial ligand #1: HIS

chainID: A,
resSeq: 346,
Coordination distance[Å]: 2.107
molecule: Indoleamine 2,3-dioxygenase 1
EC number: 1.13.11.52
Organism: Homo sapiens

axial ligand #2: PKL

chainID: A,
resSeq: 502,
Coordination distance[Å]: 2.142
molecule: N-[2-(3-chlorophenyl)ethyl]-3-(4-methylphenyl)imidazo[2,1-b][1,3]thiazole-5-carboxamide

List of other hemes in pdb:4pk6

ID of heme Distortion Axial ligands on heme Function & structure
4pk6-B-501
sad. +0.29
ruf. +0.24
dom. +0.02
bre. -0.01
HIS chainID: B,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 2
pocket vol.: 517.0 Å3
d(Fe-oop): 0.068 Å
PKL chainID: B, resSeq: 502,
molecule: N-[2-(3-chlorophenyl)ethyl]-3-(4-methylphenyl)imidazo[2,1-b][1,3]thiazole-5-carboxamide