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Protein data
function: oxidoreductaseexperiment: X-RAY DIFFRACTION
resolution: 2.5 Å
axial ligand #1: CYS
chainID: C,resSeq: 449,
Coordination distance[Å]: 2.26
molecule: STEROL 14-ALPHA DEMETHYLASE
EC number: 1.14.13.70
Organism: HOMO SAPIENS
axial ligand #2: VFV
chainID: C,resSeq: 580,
Coordination distance[Å]: 2.042
molecule: N-[(1R)-1-(3,4'-difluorobiphenyl-4-yl)-2-(1H-imidazol-1-yl)ethyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide
List of other hemes in pdb:4uhl
| ID of heme | Distortion | Axial ligands on heme | Function & structure | |
|---|---|---|---|---|
4uhl-A-540 |
sad. -0.02 ruf. -0.31 dom. +0.06 bre. +0.04 |
CYS | chainID: A, resSeq: 449, molecule: STEROL 14-ALPHA DEMETHYLASE |
oxidoreductase oligomeric count: 1 pocket vol.: 428.0 Å3 d(Fe-oop): 0.088 Å |
| VFV | chainID: A, resSeq: 580, molecule: N-[(1R)-1-(3,4'-difluorobiphenyl-4-yl)-2-(1H-imidazol-1-yl)ethyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide |
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4uhl-B-540 |
sad. -0.11 ruf. -0.44 dom. +0.10 bre. +0.06 |
CYS | chainID: B, resSeq: 449, molecule: STEROL 14-ALPHA DEMETHYLASE |
oxidoreductase oligomeric count: 1 pocket vol.: 433.0 Å3 d(Fe-oop): 0.062 Å |
| VFV | chainID: B, resSeq: 580, molecule: N-[(1R)-1-(3,4'-difluorobiphenyl-4-yl)-2-(1H-imidazol-1-yl)ethyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide |
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4uhl-D-540 |
sad. -0.08 ruf. -0.31 dom. +0.12 bre. +0.07 |
CYS | chainID: D, resSeq: 449, molecule: STEROL 14-ALPHA DEMETHYLASE |
oxidoreductase oligomeric count: 1 pocket vol.: 434.0 Å3 d(Fe-oop): 0.089 Å |
| VFV | chainID: D, resSeq: 580, molecule: N-[(1R)-1-(3,4'-difluorobiphenyl-4-yl)-2-(1H-imidazol-1-yl)ethyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide |
|||
4uhl-E-540 |
sad. -0.12 ruf. -0.36 dom. +0.12 bre. +0.06 |
CYS | chainID: E, resSeq: 449, molecule: STEROL 14-ALPHA DEMETHYLASE |
oxidoreductase oligomeric count: 1 pocket vol.: 432.0 Å3 d(Fe-oop): 0.057 Å |
| VFV | chainID: E, resSeq: 580, molecule: N-[(1R)-1-(3,4'-difluorobiphenyl-4-yl)-2-(1H-imidazol-1-yl)ethyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide |
|||
4uhl-F-540 |
sad. -0.09 ruf. -0.21 dom. +0.21 bre. +0.07 |
CYS | chainID: F, resSeq: 449, molecule: STEROL 14-ALPHA DEMETHYLASE |
oxidoreductase oligomeric count: 1 pocket vol.: 438.0 Å3 d(Fe-oop): 0.077 Å |
| VFV | chainID: F, resSeq: 580, molecule: N-[(1R)-1-(3,4'-difluorobiphenyl-4-yl)-2-(1H-imidazol-1-yl)ethyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide |
|||
4uhl-G-540 |
sad. -0.08 ruf. -0.27 dom. +0.10 bre. +0.07 |
CYS | chainID: G, resSeq: 449, molecule: STEROL 14-ALPHA DEMETHYLASE |
oxidoreductase oligomeric count: 1 pocket vol.: 429.0 Å3 d(Fe-oop): 0.000 Å |
| VFV | chainID: G, resSeq: 580, molecule: N-[(1R)-1-(3,4'-difluorobiphenyl-4-yl)-2-(1H-imidazol-1-yl)ethyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide |
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4uhl-H-540 |
sad. -0.07 ruf. -0.35 dom. +0.13 bre. +0.07 |
CYS | chainID: H, resSeq: 449, molecule: STEROL 14-ALPHA DEMETHYLASE |
oxidoreductase oligomeric count: 1 pocket vol.: 435.0 Å3 d(Fe-oop): 0.065 Å |
| VFV | chainID: H, resSeq: 580, molecule: N-[(1R)-1-(3,4'-difluorobiphenyl-4-yl)-2-(1H-imidazol-1-yl)ethyl]-4-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide |
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