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PyDISH No: 19191

PDB: 9ifq,
chainID: A, resSeq: 401
heme type: B

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 2.0 Å
origomeric count: 1

axial ligand #1: CYS

chainID: A,
resSeq: 52,
Coordination distance[Å]: 2.275
molecule: Heme-thiolate peroxidase
EC number: 1.11.2.1
Organism: Candolleomyces aberdarensis

axial ligand #2: FUX

chainID: A,
resSeq: 409,
Coordination distance[Å]: 2.245
molecule: 5-HYDROXYMETHYL-FURFURAL

List of other hemes in pdb:9ifq

ID of heme Distortion Axial ligands on heme Function & structure
9ifq-B-414
sad. -0.29
ruf. -0.07
dom. +0.01
bre. +0.04
CYS chainID: B,
resSeq: 52,
molecule: Heme-thiolate peroxidase
oxidoreductase
oligomeric count: 1
pocket vol.: 423.0 Å3
d(Fe-oop): 0.068 Å
FUX chainID: B, resSeq: 412,
molecule: 5-HYDROXYMETHYL-FURFURAL
9ifq-C-414
sad. -0.28
ruf. +0.01
dom. -0.03
bre. +0.03
CYS chainID: C,
resSeq: 52,
molecule: Heme-thiolate peroxidase
oxidoreductase
oligomeric count: 1
pocket vol.: 404.0 Å3
d(Fe-oop): 0.023 Å
FUX chainID: C, resSeq: 412,
molecule: 5-HYDROXYMETHYL-FURFURAL