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PyDISH No: 15658

PDB: 7r1i,
chainID: A, resSeq: 501
heme type: B

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 2.24 Å
origomeric count: 1

axial ligand #1: CYS

chainID: A,
resSeq: 377,
Coordination distance[Å]: 2.486
molecule: Steroid C26-monooxygenase
EC number: 1.14.15.29
Organism: Mycobacterium tuberculosis H37Rv

axial ligand #2: HOH

chainID: A,
resSeq: 614,
Coordination distance[Å]: 2.221
molecule: water

List of other hemes in pdb:7r1i

ID of heme Distortion Axial ligands on heme Function & structure
7r1i-B-501
sad. -0.20
ruf. -0.53
dom. -0.08
bre. -0.18
CYS chainID: B,
resSeq: 377,
molecule: Steroid C26-monooxygenase
oxidoreductase
oligomeric count: 1
pocket vol.: 414.0 Å3
d(Fe-oop): 0.026 Å
HOH chainID: B, resSeq: 607,
molecule: water
7r1i-C-501
sad. -0.13
ruf. -0.40
dom. -0.08
bre. -0.22
CYS chainID: C,
resSeq: 377,
molecule: Steroid C26-monooxygenase
oxidoreductase
oligomeric count: 1
pocket vol.: 380.0 Å3
d(Fe-oop): 0.122 Å
HOH chainID: C, resSeq: 602,
molecule: water