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PyDISH No: 05654

PDB: 3g1q,
chainID: A, resSeq: 480
heme type: B

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 1.89 Å

axial ligand #1: CYS

chainID: A,
resSeq: 422,
Coordination distance[Å]: 2.317
molecule: Sterol 14-alpha-demethylase
EC number: 1.14.13.70
Organism: Trypanosoma brucei

axial ligand #2: HOH

chainID: A,
resSeq: 525,
Coordination distance[Å]: 2.928
molecule: water

List of other hemes in pdb:3g1q

ID of heme Distortion Axial ligands on heme Function & structure
3g1q-B-480
 sad. -0.17
ruf. -0.54
dom. -0.22
bre. -0.19
 CYS chainID: B,
resSeq: 422,
molecule: Sterol 14-alpha-demethylase		 oxidoreductase
oligomeric count: 1
pocket vol.: 440.0 Å3
d(Fe-oop): 0.264 Å
HOH chainID: B, resSeq: 551,
molecule: water
3g1q-C-480
 sad. -0.06
ruf. -0.47
dom. -0.19
bre. -0.14
 CYS chainID: C,
resSeq: 422,
molecule: Sterol 14-alpha-demethylase		 oxidoreductase
oligomeric count: 1
pocket vol.: 401.0 Å3
d(Fe-oop): 0.260 Å
HOH chainID: C, resSeq: 523,
molecule: water
3g1q-D-480
 sad. -0.11
ruf. -0.57
dom. -0.20
bre. -0.21
 CYS chainID: D,
resSeq: 422,
molecule: Sterol 14-alpha-demethylase		 oxidoreductase
oligomeric count: 1
pocket vol.: 419.0 Å3
d(Fe-oop): 0.245 Å
Not assigned.