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PyDISH No: 07251

PDB: 3tbg,
chainID: C, resSeq: 800
heme type: B

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 2.1 Å

axial ligand #1: CYS

chainID: C,
resSeq: 443,
Coordination distance[Å]: 2.376
molecule: Cytochrome P450 2D6
EC number: 1.14.14.1
Organism: Homo sapiens

axial ligand #2: HOH

chainID: C,
resSeq: 608,
Coordination distance[Å]: 2.797
molecule: water

List of other hemes in pdb:3tbg

ID of heme Distortion Axial ligands on heme Function & structure
3tbg-A-800
sad. -0.11
ruf. -0.11
dom. -0.10
bre. -0.10
CYS chainID: A,
resSeq: 443,
molecule: Cytochrome P450 2D6
oxidoreductase
oligomeric count: 1
pocket vol.: 378.0 Å3
d(Fe-oop): 0.093 Å
HOH chainID: A, resSeq: 614,
molecule: water
3tbg-B-800
sad. -0.16
ruf. -0.23
dom. -0.05
bre. -0.11
CYS chainID: B,
resSeq: 443,
molecule: Cytochrome P450 2D6
oxidoreductase
oligomeric count: 1
pocket vol.: 384.0 Å3
d(Fe-oop): 0.104 Å
HOH chainID: B, resSeq: 589,
molecule: water
3tbg-D-800
sad. -0.18
ruf. -0.23
dom. -0.14
bre. -0.11
CYS chainID: D,
resSeq: 443,
molecule: Cytochrome P450 2D6
oxidoreductase
oligomeric count: 1
pocket vol.: 402.0 Å3
d(Fe-oop): 0.086 Å
Not assigned.