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PyDISH No: 18233

PDB: 8w1w,
chainID: A, resSeq: 801
heme type: B

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 2.033 Å

axial ligand #1: TOX

chainID: A,
resSeq: 107,
Coordination distance[Å]: 2.854
molecule: Catalase-peroxidase
EC number: 1.11.1.21
Organism: Mycobacterium tuberculosis

axial ligand #2: HIS

chainID: A,
resSeq: 270,
Coordination distance[Å]: 2.311
molecule: same as ligand #1

List of other hemes in pdb:8w1w

ID of heme	Distortion	Axial ligands on heme		Function & structure
8w1w-B-801	`sad. -0.84 ruf. +0.00 dom. +0.01 bre. +0.11`	TOX	chainID: B, resSeq: 107, molecule: Catalase-peroxidase	oxidoreductase oligomeric count: 2 pocket vol.: 402.0 Å³ d(Fe-oop): 0.285 Å
8w1w-B-801	`sad. -0.84 ruf. +0.00 dom. +0.01 bre. +0.11`	HIS	chainID: B, resSeq: 270, molecule: Catalase-peroxidase
8w1w-C-801	`sad. -0.96 ruf. +0.01 dom. +0.05 bre. -0.08`	TOX	chainID: C, resSeq: 107, molecule: Catalase-peroxidase	oxidoreductase oligomeric count: 2 pocket vol.: 406.0 Å³ d(Fe-oop): 0.292 Å
8w1w-C-801	`sad. -0.96 ruf. +0.01 dom. +0.05 bre. -0.08`	HIS	chainID: C, resSeq: 270, molecule: Catalase-peroxidase
8w1w-D-801	`sad. -0.92 ruf. -0.02 dom. +0.05 bre. -0.06`	TOX	chainID: D, resSeq: 107, molecule: Catalase-peroxidase	oxidoreductase oligomeric count: 2 pocket vol.: 408.0 Å³ d(Fe-oop): 0.329 Å
8w1w-D-801	`sad. -0.92 ruf. -0.02 dom. +0.05 bre. -0.06`	HIS	chainID: D, resSeq: 270, molecule: Catalase-peroxidase