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PyDISH No: 08167

PDB: 4d3a,
chainID: B, resSeq: 500
heme type: B

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 2.252 Å

axial ligand #1: CYS

chainID: B,
resSeq: 186,
Coordination distance[Å]: 2.258
molecule: NITRIC OXIDE SYNTHASE, ENDOTHELIAL
EC number: 1.14.13.39
Organism: BOS TAURUS

axial ligand #2: 7F5

chainID: B,
resSeq: 800,
Coordination distance[Å]: 2.264
molecule: 3-(3-fluorophenyl)-N-{2-[2-(5-methyl-1H-imidazol-1-yl)pyrimidin-4-yl]ethyl}propan-1-amine

List of other hemes in pdb:4d3a

ID of heme Distortion Axial ligands on heme Function & structure
4d3a-A-500
sad. -0.42
ruf. -0.38
dom. +0.35
bre. -0.21
CYS chainID: A,
resSeq: 186,
molecule: NITRIC OXIDE SYNTHASE, ENDOTHELIAL
oxidoreductase
oligomeric count: 2
pocket vol.: 472.0 Å3
d(Fe-oop): 0.074 Å
7F5 chainID: A, resSeq: 800,
molecule: 3-(3-fluorophenyl)-N-{2-[2-(5-methyl-1H-imidazol-1-yl)pyrimidin-4-yl]ethyl}propan-1-amine