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PyDISH No: 08475

PDB: 4g1b,
chainID: B, resSeq: 401
heme type: B

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 3.0 Å

axial ligand #1: HIS

chainID: B,
resSeq: 85,
Coordination distance[Å]: 2.1
molecule: Flavohemoglobin
Organism: Saccharomyces cerevisiae

axial ligand #2: ECN

chainID: B,
resSeq: 403,
Coordination distance[Å]: 2.028
molecule: 1-[(2S)-2-[(4-CHLOROBENZYL)OXY]-2-(2,4-DICHLOROPHENYL)ETHYL]-1H-IMIDAZOLE

List of other hemes in pdb:4g1b

ID of heme Distortion Axial ligands on heme Function & structure
4g1b-A-401
 sad. -0.14
ruf. -0.68
dom. -0.36
bre. -0.07
 HIS chainID: A,
resSeq: 85,
molecule: Flavohemoglobin		 oxidoreductase
oligomeric count: 1
pocket vol.: 482.0 Å3
d(Fe-oop): 0.032 Å
ECN chainID: A, resSeq: 403,
molecule: 1-[(2S)-2-[(4-CHLOROBENZYL)OXY]-2-(2,4-DICHLOROPHENYL)ETHYL]-1H-IMIDAZOLE
4g1b-C-401
 sad. -0.23
ruf. -0.60
dom. -0.29
bre. -0.07
 HIS chainID: C,
resSeq: 85,
molecule: Flavohemoglobin		 oxidoreductase
oligomeric count: 1
pocket vol.: 520.0 Å3
d(Fe-oop): 0.015 Å
ECN chainID: C, resSeq: 403,
molecule: 1-[(2S)-2-[(4-CHLOROBENZYL)OXY]-2-(2,4-DICHLOROPHENYL)ETHYL]-1H-IMIDAZOLE
4g1b-D-401
 sad. -0.20
ruf. -0.71
dom. -0.34
bre. -0.09
 HIS chainID: D,
resSeq: 85,
molecule: Flavohemoglobin		 oxidoreductase
oligomeric count: 1
pocket vol.: 520.0 Å3
d(Fe-oop): 0.019 Å
ECN chainID: D, resSeq: 403,
molecule: 1-[(2S)-2-[(4-CHLOROBENZYL)OXY]-2-(2,4-DICHLOROPHENYL)ETHYL]-1H-IMIDAZOLE