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PyDISH No: 16824

PDB: 8dwr,
chainID: D, resSeq: 801
heme type: B

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 2.1 Å

axial ligand #1: TOX

chainID: D,
resSeq: 107,
Coordination distance[Å]: 2.689
molecule: Catalase-peroxidase
EC number: 1.11.1.21
Organism: Mycobacterium tuberculosis

axial ligand #2: HIS

chainID: D,
resSeq: 270,
Coordination distance[Å]: 2.604
molecule: same as ligand #1

List of other hemes in pdb:8dwr

ID of heme	Distortion	Axial ligands on heme		Function & structure
8dwr-A-801	`sad. -0.77 ruf. +0.29 dom. -0.02 bre. -0.16`	TOX	chainID: A, resSeq: 107, molecule: Catalase-peroxidase	oxidoreductase oligomeric count: 2 pocket vol.: 413.0 Å³ d(Fe-oop): 0.127 Å
8dwr-A-801	`sad. -0.77 ruf. +0.29 dom. -0.02 bre. -0.16`	HIS	chainID: A, resSeq: 270, molecule: Catalase-peroxidase
8dwr-B-802	`sad. -0.78 ruf. +0.32 dom. -0.01 bre. -0.16`	TOX	chainID: B, resSeq: 107, molecule: Catalase-peroxidase	oxidoreductase oligomeric count: 2 pocket vol.: 424.0 Å³ d(Fe-oop): 0.122 Å
8dwr-B-802	`sad. -0.78 ruf. +0.32 dom. -0.01 bre. -0.16`	HIS	chainID: B, resSeq: 270, molecule: Catalase-peroxidase
8dwr-C-801	`sad. -0.76 ruf. +0.44 dom. +0.02 bre. -0.14`	TOX	chainID: C, resSeq: 107, molecule: Catalase-peroxidase	oxidoreductase oligomeric count: 2 pocket vol.: 417.0 Å³ d(Fe-oop): 0.121 Å
8dwr-C-801	`sad. -0.76 ruf. +0.44 dom. +0.02 bre. -0.14`	HIS	chainID: C, resSeq: 270, molecule: Catalase-peroxidase