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PyDISH No: 07993

PDB: 4c28,
chainID: B, resSeq: 1450
heme type: B

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 2.03 Å
origomeric count: 1

axial ligand #1: CYS

chainID: B,
resSeq: 422,
Coordination distance[Å]: 2.229
molecule: STEROL 14-ALPHA DEMETHYLASE
EC number: 1.14.13.70
Organism: TRYPANOSOMA CRUZI

axial ligand #2: TW5

chainID: B,
resSeq: 1460,
Coordination distance[Å]: 2.12
molecule: (R)-N-(3-(1H-indol-3-yl)-1-oxo-1-(pyridin-4-ylamino)propan-2-yl)-4-(4-(4-chlorophenyl)piperazin-1-yl)-2-fluorobenzamide

List of other hemes in pdb:4c28

ID of heme Distortion Axial ligands on heme Function & structure
4c28-A-1450
sad. -0.07
ruf. -0.69
dom. +0.07
bre. +0.04
CYS chainID: A,
resSeq: 422,
molecule: STEROL 14-ALPHA DEMETHYLASE
oxidoreductase
oligomeric count: 1
pocket vol.: 453.0 Å3
d(Fe-oop): 0.001 Å
TW5 chainID: A, resSeq: 1460,
molecule: (R)-N-(3-(1H-indol-3-yl)-1-oxo-1-(pyridin-4-ylamino)propan-2-yl)-4-(4-(4-chlorophenyl)piperazin-1-yl)-2-fluorobenzamide