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PyDISH No: 05399

PDB: 3dtu,
chainID: A, resSeq: 1502
heme type: A

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 2.15 Å

axial ligand #1: HIS

chainID: A,
resSeq: 102,
Coordination distance[Å]: 2.013
molecule: Cytochrome c oxidase subunit 1
EC number: 1.9.3.1
Organism: Rhodobacter sphaeroides

axial ligand #2: HIS

chainID: A,
resSeq: 421,
Coordination distance[Å]: 2.08
molecule: same as ligand #1

List of other hemes in pdb:3dtu

ID of heme	Distortion	Axial ligands on heme		Function & structure
3dtu-A-1503	`sad. -0.38 ruf. +0.05 dom. +0.48 bre. -0.33`	HIS	chainID: A, resSeq: 419, molecule: Cytochrome c oxidase subunit 1	oxidoreductase oligomeric count: 2 pocket vol.: 713.0 Å³ d(Fe-oop): 0.171 Å
3dtu-A-1503	`sad. -0.38 ruf. +0.05 dom. +0.48 bre. -0.33`	HOH	chainID: A, resSeq: 1511, molecule: water
3dtu-C-574	`sad. -0.71 ruf. +0.28 dom. +0.17 bre. +0.05`	HIS	chainID: C, resSeq: 102, molecule: Cytochrome c oxidase subunit 1	oxidoreductase oligomeric count: 2 pocket vol.: 578.0 Å³ d(Fe-oop): 0.026 Å
3dtu-C-574	`sad. -0.71 ruf. +0.28 dom. +0.17 bre. +0.05`	HIS	chainID: C, resSeq: 421, molecule: Cytochrome c oxidase subunit 1
3dtu-C-575	`sad. -0.31 ruf. +0.05 dom. +0.49 bre. -0.30`	HIS	chainID: C, resSeq: 419, molecule: Cytochrome c oxidase subunit 1	oxidoreductase oligomeric count: 2 pocket vol.: 680.0 Å³ d(Fe-oop): 0.218 Å
3dtu-C-575	`sad. -0.31 ruf. +0.05 dom. +0.49 bre. -0.30`	HOH	chainID: C, resSeq: 589, molecule: water