Browser

PyDISH No: 12386

PDB: 6e40,
chainID: D, resSeq: 501
heme type: B

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 2.306 Å

axial ligand #1: HIS

chainID: D,
resSeq: 346,
Coordination distance[Å]: 2.072
molecule: Indoleamine 2,3-dioxygenase 1
EC number: 1.13.11.52
Organism: Homo sapiens

axial ligand #2: BBJ

chainID: D,
resSeq: 502,
Coordination distance[Å]: 1.789
molecule: N-(3-bromo-4-fluorophenyl)-N'-hydroxy-4-{[2-(sulfamoylamino)ethyl]amino}-1,2,5-oxadiazole-3-carboximidamide

List of other hemes in pdb:6e40

ID of heme Distortion Axial ligands on heme Function & structure
6e40-A-501
sad. +0.30
ruf. +0.36
dom. -0.07
bre. -0.25
HIS chainID: A,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 499.0 Å3
d(Fe-oop): 0.039 Å
BBJ chainID: A, resSeq: 502,
molecule: N-(3-bromo-4-fluorophenyl)-N'-hydroxy-4-{[2-(sulfamoylamino)ethyl]amino}-1,2,5-oxadiazole-3-carboximidamide
6e40-B-501
sad. +0.38
ruf. +0.63
dom. -0.19
bre. -0.09
HIS chainID: B,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 502.0 Å3
d(Fe-oop): 0.120 Å
BBJ chainID: B, resSeq: 502,
molecule: N-(3-bromo-4-fluorophenyl)-N'-hydroxy-4-{[2-(sulfamoylamino)ethyl]amino}-1,2,5-oxadiazole-3-carboximidamide
6e40-C-501
sad. +0.41
ruf. +0.49
dom. -0.06
bre. -0.22
HIS chainID: C,
resSeq: 346,
molecule: Indoleamine 2,3-dioxygenase 1
oxidoreductase
oligomeric count: 1
pocket vol.: 518.0 Å3
d(Fe-oop): 0.264 Å
Not assigned.