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PyDISH No: 05864

PDB: 3hq9,
chainID: A, resSeq: 401
heme type: C

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 1.52 Å

axial ligand #1: HIS

chainID: A,
resSeq: 223,
Coordination distance[Å]: 2.016
molecule: Cytochrome c551 peroxidase
EC number: 1.11.1.5
Organism: Geobacter sulfurreducens

axial ligand #2: MET

chainID: A,
resSeq: 297,
Coordination distance[Å]: 2.337
molecule: same as ligand #1

List of other hemes in pdb:3hq9

ID of heme Distortion Axial ligands on heme Function & structure
3hq9-A-400
sad. +0.71
ruf. -1.14
dom. +0.03
bre. +0.07
HIS chainID: A,
resSeq: 77,
molecule: Cytochrome c551 peroxidase
oxidoreductase
oligomeric count: 2
pocket vol.: 481.0 Å3
d(Fe-oop): 0.017 Å
IMD chainID: A, resSeq: 346,
molecule: IMIDAZOLE
3hq9-B-400
sad. +0.93
ruf. -1.20
dom. -0.11
bre. +0.06
HIS chainID: B,
resSeq: 77,
molecule: Cytochrome c551 peroxidase
oxidoreductase
oligomeric count: 2
pocket vol.: 527.0 Å3
d(Fe-oop): 0.004 Å
IMD chainID: B, resSeq: 346,
molecule: IMIDAZOLE
3hq9-B-401
sad. +0.57
ruf. -0.80
dom. +0.16
bre. -0.01
HIS chainID: B,
resSeq: 223,
molecule: Cytochrome c551 peroxidase
oxidoreductase
oligomeric count: 2
pocket vol.: 345.0 Å3
d(Fe-oop): 0.012 Å
MET chainID: B, resSeq: 297,
molecule: Cytochrome c551 peroxidase