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PyDISH No: 18240

PDB: 8w1y,
chainID: B, resSeq: 801
heme type: B

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 2.3 Å

axial ligand #1: TOX

chainID: B,
resSeq: 107,
Coordination distance[Å]: 2.726
molecule: Catalase-peroxidase
EC number: 1.11.1.21
Organism: Mycobacterium tuberculosis

axial ligand #2: HIS

chainID: B,
resSeq: 270,
Coordination distance[Å]: 2.418
molecule: same as ligand #1

List of other hemes in pdb:8w1y

ID of heme	Distortion	Axial ligands on heme		Function & structure
8w1y-A-801	`sad. -0.87 ruf. -0.06 dom. -0.00 bre. -0.15`	TOX	chainID: A, resSeq: 107, molecule: Catalase-peroxidase	oxidoreductase oligomeric count: 2 pocket vol.: 395.0 Å³ d(Fe-oop): 0.207 Å
8w1y-A-801	`sad. -0.87 ruf. -0.06 dom. -0.00 bre. -0.15`	HIS	chainID: A, resSeq: 270, molecule: Catalase-peroxidase
8w1y-C-801	`sad. -0.86 ruf. +0.10 dom. -0.01 bre. -0.18`	TOX	chainID: C, resSeq: 107, molecule: Catalase-peroxidase	oxidoreductase oligomeric count: 2 pocket vol.: 375.0 Å³ d(Fe-oop): 0.204 Å
8w1y-C-801	`sad. -0.86 ruf. +0.10 dom. -0.01 bre. -0.18`	HIS	chainID: C, resSeq: 270, molecule: Catalase-peroxidase
8w1y-D-801	`sad. -0.73 ruf. +0.11 dom. +0.00 bre. -0.07`	TOX	chainID: D, resSeq: 107, molecule: Catalase-peroxidase	oxidoreductase oligomeric count: 2 pocket vol.: 397.0 Å³ d(Fe-oop): 0.129 Å
8w1y-D-801	`sad. -0.73 ruf. +0.11 dom. +0.00 bre. -0.07`	HIS	chainID: D, resSeq: 270, molecule: Catalase-peroxidase