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PyDISH No: 12395

PDB: 6e44,
chainID: A, resSeq: 501
heme type: B

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 1.903 Å

axial ligand #1: ALA

chainID: A,
resSeq: 264,
Coordination distance[Å]: 2.477
molecule: Indoleamine 2,3-dioxygenase 1
EC number: 1.13.11.52
Organism: Homo sapiens

axial ligand #2: HIS

chainID: A,
resSeq: 346,
Coordination distance[Å]: 2.044
molecule: same as ligand #1

List of other hemes in pdb:6e44

ID of heme Distortion Axial ligands on heme Function & structure
6e44-B-501
sad. +0.35
ruf. -0.40
dom. -0.18
bre. -0.06
HIS chainID: B,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 471.0 Å3
d(Fe-oop): 0.080 Å
Not assigned.
6e44-C-501
sad. +0.45
ruf. -0.23
dom. -0.15
bre. -0.11
ALA chainID: C,
resSeq: 264,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 446.0 Å3
d(Fe-oop): 0.003 Å
HIS chainID: C, resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
6e44-D-501
sad. +0.46
ruf. -0.22
dom. -0.27
bre. -0.03
HIS chainID: D,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 476.0 Å3
d(Fe-oop): 0.088 Å
Not assigned.