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PyDISH No: 12391

PDB: 6e42,
chainID: A, resSeq: 501
heme type: B

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 2.103 Å

axial ligand #1: HIS

chainID: A,
resSeq: 346,
Coordination distance[Å]: 2.077
molecule: Indoleamine 2,3-dioxygenase 1
EC number: 1.13.11.52
Organism: Homo sapiens

axial ligand #2: HQJ

chainID: A,
resSeq: 502,
Coordination distance[Å]: 2.063
molecule: 4-(3-chlorophenyl)-1H-imidazole

List of other hemes in pdb:6e42

ID of heme	Distortion	Axial ligands on heme		Function & structure
6e42-B-501	`sad. +0.36 ruf. +0.13 dom. -0.26 bre. -0.07`	HIS	chainID: B, resSeq: 346, molecule: Indoleamine 2,3-dioxygenase 1	oxidoreductase oligomeric count: 1 pocket vol.: 480.0 Å³ d(Fe-oop): 0.035 Å
6e42-B-501	`sad. +0.36 ruf. +0.13 dom. -0.26 bre. -0.07`	HQJ	chainID: B, resSeq: 502, molecule: 4-(3-chlorophenyl)-1H-imidazole
6e42-C-501	`sad. +0.31 ruf. +0.04 dom. -0.21 bre. -0.06`	HIS	chainID: C, resSeq: 346, molecule: Indoleamine 2,3-dioxygenase 1	oxidoreductase oligomeric count: 1 pocket vol.: 497.0 Å³ d(Fe-oop): 0.042 Å
6e42-C-501	`sad. +0.31 ruf. +0.04 dom. -0.21 bre. -0.06`	HQJ	chainID: C, resSeq: 502, molecule: 4-(3-chlorophenyl)-1H-imidazole
6e42-D-501	`sad. +0.30 ruf. -0.00 dom. -0.29 bre. -0.07`	HIS	chainID: D, resSeq: 346, molecule: Indoleamine 2,3-dioxygenase 1	oxidoreductase oligomeric count: 1 pocket vol.: 484.0 Å³ d(Fe-oop): 0.044 Å
6e42-D-501	`sad. +0.30 ruf. -0.00 dom. -0.29 bre. -0.07`	HQJ	chainID: D, resSeq: 502, molecule: 4-(3-chlorophenyl)-1H-imidazole