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PyDISH No: 08409

PDB: 4fb2,
chainID: C, resSeq: 501
heme type: B

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 1.37 Å

axial ligand #1: CYS

chainID: C,
resSeq: 347,
Coordination distance[Å]: 2.324
molecule: P450cin
Organism: Citrobacter braakii

axial ligand #2: HOH

chainID: C,
resSeq: 670,
Coordination distance[Å]: 2.452
molecule: water

List of other hemes in pdb:4fb2

ID of heme Distortion Axial ligands on heme Function & structure
4fb2-A-501
sad. -0.35
ruf. -0.27
dom. -0.02
bre. -0.17
CYS chainID: A,
resSeq: 347,
molecule: P450cin
oxidoreductase
oligomeric count: 1
pocket vol.: 444.0 Å3
d(Fe-oop): 0.233 Å
HOH chainID: A, resSeq: 730,
molecule: water
4fb2-B-501
sad. -0.28
ruf. -0.27
dom. +0.00
bre. -0.09
CYS chainID: B,
resSeq: 347,
molecule: P450cin
oxidoreductase
oligomeric count: 1
pocket vol.: 433.0 Å3
d(Fe-oop): 0.281 Å
HOH chainID: B, resSeq: 750,
molecule: water
4fb2-D-501
sad. -0.32
ruf. -0.29
dom. +0.01
bre. -0.10
CYS chainID: D,
resSeq: 347,
molecule: P450cin
oxidoreductase
oligomeric count: 1
pocket vol.: 432.0 Å3
d(Fe-oop): 0.286 Å
HOH chainID: D, resSeq: 1054,
molecule: water