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PyDISH No: 09576

PDB: 4qop,
chainID: D, resSeq: 501
heme type: B

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 1.9 Å

axial ligand #1: TYR

chainID: D,
resSeq: 340,
Coordination distance[Å]: 2.172
molecule: Catalase
EC number: 1.11.1.6
Organism: Bacillus pumilus

axial ligand #2: HOH

chainID: D,
resSeq: 932,
Coordination distance[Å]: 2.725
molecule: water

List of other hemes in pdb:4qop

ID of heme	Distortion	Axial ligands on heme		Function & structure
4qop-A-501	`sad. -0.12 ruf. +0.38 dom. +0.26 bre. -0.05`	TYR	chainID: A, resSeq: 340, molecule: Catalase	oxidoreductase oligomeric count: 4 pocket vol.: 350.0 Å³ d(Fe-oop): 0.016 Å
4qop-A-501	`sad. -0.12 ruf. +0.38 dom. +0.26 bre. -0.05`	Not assigned.
4qop-A-502	`sad. +0.20 ruf. -0.44 dom. -0.35 bre. -0.02`	TYR	chainID: A, resSeq: 340, molecule: Catalase	oxidoreductase oligomeric count: 4 pocket vol.: 348.0 Å³ d(Fe-oop): 0.042 Å
4qop-A-502	`sad. +0.20 ruf. -0.44 dom. -0.35 bre. -0.02`	Not assigned.
4qop-B-501	`sad. -0.14 ruf. +0.53 dom. +0.46 bre. +0.01`	TYR	chainID: B, resSeq: 340, molecule: Catalase	oxidoreductase oligomeric count: 4 pocket vol.: 338.0 Å³ d(Fe-oop): 0.058 Å
4qop-B-501	`sad. -0.14 ruf. +0.53 dom. +0.46 bre. +0.01`	HOH	chainID: B, resSeq: 936, molecule: water
4qop-B-502	`sad. +0.19 ruf. -0.47 dom. -0.30 bre. -0.04`	TYR	chainID: B, resSeq: 340, molecule: Catalase	oxidoreductase oligomeric count: 4 pocket vol.: 345.0 Å³ d(Fe-oop): 0.051 Å
4qop-B-502	`sad. +0.19 ruf. -0.47 dom. -0.30 bre. -0.04`	HOH	chainID: B, resSeq: 936, molecule: water
4qop-C-501	`sad. -0.03 ruf. +0.35 dom. +0.40 bre. -0.04`	TYR	chainID: C, resSeq: 340, molecule: Catalase	oxidoreductase oligomeric count: 4 pocket vol.: 349.0 Å³ d(Fe-oop): 0.029 Å
4qop-C-501	`sad. -0.03 ruf. +0.35 dom. +0.40 bre. -0.04`	HOH	chainID: C, resSeq: 962, molecule: water
4qop-C-502	`sad. +0.21 ruf. -0.55 dom. -0.29 bre. -0.08`	TYR	chainID: C, resSeq: 340, molecule: Catalase	oxidoreductase oligomeric count: 4 pocket vol.: 352.0 Å³ d(Fe-oop): 0.041 Å
4qop-C-502	`sad. +0.21 ruf. -0.55 dom. -0.29 bre. -0.08`	HOH	chainID: C, resSeq: 962, molecule: water
4qop-D-502	`sad. +0.09 ruf. -0.36 dom. -0.10 bre. +0.01`	TYR	chainID: D, resSeq: 340, molecule: Catalase	oxidoreductase oligomeric count: 4 pocket vol.: 354.0 Å³ d(Fe-oop): 0.061 Å
4qop-D-502	`sad. +0.09 ruf. -0.36 dom. -0.10 bre. +0.01`	Not assigned.