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PyDISH No: 18532

PDB: 9ca3,
chainID: A, resSeq: 301
heme type: B

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 1.89 Å
origomeric count: 4

axial ligand #1: HIS

chainID: A,
resSeq: 201,
Coordination distance[Å]: 2.298
molecule: Tryptophan 2,3-dioxygenase
Organism: Streptomyces sp. B9173

axial ligand #2: CYN

chainID: A,
resSeq: 302,
Coordination distance[Å]: 2.117
molecule: CYANIDE ION

List of other hemes in pdb:9ca3

ID of heme Distortion Axial ligands on heme Function & structure
9ca3-B-301
sad. -0.02
ruf. +0.01
dom. +0.01
bre. -0.07
HIS chainID: B,
resSeq: 201,
molecule: Tryptophan 2,3-dioxygenase
oxidoreductase
oligomeric count: 4
pocket vol.: 435.0 Å3
d(Fe-oop): 0.042 Å
CYN chainID: B, resSeq: 302,
molecule: CYANIDE ION
9ca3-C-301
sad. -0.12
ruf. +0.02
dom. +0.07
bre. -0.08
HIS chainID: C,
resSeq: 201,
molecule: Tryptophan 2,3-dioxygenase
oxidoreductase
oligomeric count: 4
pocket vol.: 430.0 Å3
d(Fe-oop): 0.027 Å
CYN chainID: C, resSeq: 302,
molecule: CYANIDE ION
9ca3-D-301
sad. -0.17
ruf. +0.09
dom. +0.06
bre. -0.19
HIS chainID: D,
resSeq: 201,
molecule: Tryptophan 2,3-dioxygenase
oxidoreductase
oligomeric count: 4
pocket vol.: 432.0 Å3
d(Fe-oop): 0.018 Å
CYN chainID: D, resSeq: 302,
molecule: CYANIDE ION