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PyDISH No: 05101

PDB: 3ag4,
chainID: N, resSeq: 516
heme type: A

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 2.05 Å

axial ligand #1: HIS

chainID: N,
resSeq: 376,
Coordination distance[Å]: 2.175
molecule: Cytochrome c oxidase subunit 1
EC number: 1.9.3.1
Organism: Bos taurus

axial ligand #2: CYN

chainID: N,
resSeq: 520,
Coordination distance[Å]: 2.593
molecule: CYANIDE ION

List of other hemes in pdb:3ag4

ID of heme	Distortion	Axial ligands on heme		Function & structure
3ag4-A-515	`sad. -0.64 ruf. +0.32 dom. +0.22 bre. -0.27`	HIS	chainID: A, resSeq: 61, molecule: Cytochrome c oxidase subunit 1	oxidoreductase oligomeric count: 13 pocket vol.: 594.0 Å³ d(Fe-oop): 0.073 Å
3ag4-A-515	`sad. -0.64 ruf. +0.32 dom. +0.22 bre. -0.27`	HIS	chainID: A, resSeq: 378, molecule: Cytochrome c oxidase subunit 1
3ag4-A-516	`sad. -0.45 ruf. +0.05 dom. +0.32 bre. +0.14`	HIS	chainID: A, resSeq: 376, molecule: Cytochrome c oxidase subunit 1	oxidoreductase oligomeric count: 13 pocket vol.: 707.0 Å³ d(Fe-oop): 0.092 Å
3ag4-A-516	`sad. -0.45 ruf. +0.05 dom. +0.32 bre. +0.14`	CYN	chainID: A, resSeq: 520, molecule: CYANIDE ION
3ag4-N-515	`sad. -0.55 ruf. +0.29 dom. +0.18 bre. -0.16`	HIS	chainID: N, resSeq: 61, molecule: Cytochrome c oxidase subunit 1	oxidoreductase oligomeric count: 13 pocket vol.: 625.0 Å³ d(Fe-oop): 0.053 Å
3ag4-N-515	`sad. -0.55 ruf. +0.29 dom. +0.18 bre. -0.16`	HIS	chainID: N, resSeq: 378, molecule: Cytochrome c oxidase subunit 1