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PyDISH No: 15178

PDB: 7kvs,
chainID: A, resSeq: 601
heme type: B

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 2.5 Å

axial ligand #1: CYS

chainID: A,
resSeq: 442,
Coordination distance[Å]: 2.4
molecule: Cytochrome P450 3A4
EC number: 1.14.14.1,1.14.14.56,1.14.14.73,1.14.14.55
Organism: Homo sapiens

axial ligand #2: X74

chainID: A,
resSeq: 605,
Coordination distance[Å]: 2.085
molecule: tert-butyl [(2R)-1-(naphthalen-1-yl)-3-{[(2R)-1-oxo-3-phenyl-1-{[3-(pyridin-3-yl)propyl]amino}propan-2-yl]sulfanyl}propan-2-yl]carbamate

List of other hemes in pdb:7kvs

ID of heme	Distortion	Axial ligands on heme		Function & structure
7kvs-B-602	`sad. -0.32 ruf. -0.10 dom. +0.12 bre. -0.22`	CYS	chainID: B, resSeq: 442, molecule: Cytochrome P450 3A4	oxidoreductase oligomeric count: 2 pocket vol.: 416.0 Å³ d(Fe-oop): 0.098 Å
7kvs-B-602	`sad. -0.32 ruf. -0.10 dom. +0.12 bre. -0.22`	X74	chainID: B, resSeq: 603, molecule: tert-butyl [(2R)-1-(naphthalen-1-yl)-3-{[(2R)-1-oxo-3-phenyl-1-{[3-(pyridin-3-yl)propyl]amino}propan-2-yl]sulfanyl}propan-2-yl]carbamate