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PyDISH No: 12934

PDB: 6iao,
chainID: A, resSeq: 501
heme type: B

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 2.16 Å

axial ligand #1: CYS

chainID: A,
resSeq: 400,
Coordination distance[Å]: 2.307
molecule: Bifunctional cytochrome P450/NADPH--P450 reductase
EC number: 1.14.14.1,1.6.2.4
Organism: Bacillus megaterium

axial ligand #2: DTT

chainID: A,
resSeq: 502,
Coordination distance[Å]: 2.316
molecule: 2,3-DIHYDROXY-1,4-DITHIOBUTANE

List of other hemes in pdb:6iao

ID of heme Distortion Axial ligands on heme Function & structure
6iao-B-501
sad. -0.23
ruf. -0.41
dom. -0.03
bre. -0.15
CYS chainID: B,
resSeq: 400,
molecule: Bifunctional cytochrome P450/NADPH--P450 reductase
oxidoreductase
oligomeric count: 2
pocket vol.: 429.0 Å3
d(Fe-oop): 0.073 Å
DTT chainID: B, resSeq: 502,
molecule: 2,3-DIHYDROXY-1,4-DITHIOBUTANE
6iao-C-501
sad. -0.25
ruf. -0.53
dom. -0.05
bre. -0.15
CYS chainID: C,
resSeq: 400,
molecule: Bifunctional cytochrome P450/NADPH--P450 reductase
oxidoreductase
oligomeric count: 2
pocket vol.: 420.0 Å3
d(Fe-oop): 0.053 Å
DTT chainID: C, resSeq: 502,
molecule: 2,3-DIHYDROXY-1,4-DITHIOBUTANE
6iao-D-501
sad. -0.15
ruf. -0.45
dom. -0.03
bre. -0.10
CYS chainID: D,
resSeq: 400,
molecule: Bifunctional cytochrome P450/NADPH--P450 reductase
oxidoreductase
oligomeric count: 2
pocket vol.: 437.0 Å3
d(Fe-oop): 0.069 Å
DTT chainID: D, resSeq: 502,
molecule: 2,3-DIHYDROXY-1,4-DITHIOBUTANE