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PyDISH No: 01158

PDB: 1hgb,
chainID: C, resSeq: 142
heme type: B

distortion

Protein data

function: oxygen carrier
experiment: X-RAY DIFFRACTION
resolution: 2.1 Å

axial ligand #1: HIS

chainID: C,
resSeq: 87,
Coordination distance[Å]: 2.368
molecule: HEMOGLOBIN (AQUO MET) (ALPHA CHAIN)
Organism: Homo sapiens

axial ligand #2: HOH

chainID: C,
resSeq: 150,
Coordination distance[Å]: 2.27
molecule: water

List of other hemes in pdb:1hgb

ID of heme Distortion Axial ligands on heme Function & structure
1hgb-A-142
sad. -0.03
ruf. -0.61
dom. -0.41
bre. -0.11
HIS chainID: A,
resSeq: 87,
molecule: HEMOGLOBIN (AQUO MET) (ALPHA CHAIN)
oxygen carrier
oligomeric count: 4
pocket vol.: 577.0 Å3
d(Fe-oop): 0.073 Å
HOH chainID: A, resSeq: 150,
molecule: water
1hgb-B-147
sad. +0.32
ruf. -0.11
dom. -0.48
bre. -0.12
HIS chainID: B,
resSeq: 92,
molecule: HEMOGLOBIN (AQUO MET) (BETA CHAIN)
oxygen carrier
oligomeric count: 4
pocket vol.: 555.0 Å3
d(Fe-oop): 0.080 Å
HOH chainID: B, resSeq: 185,
molecule: water
1hgb-D-147
sad. +0.22
ruf. -0.11
dom. -0.39
bre. -0.13
HIS chainID: D,
resSeq: 92,
molecule: HEMOGLOBIN (AQUO MET) (BETA CHAIN)
oxygen carrier
oligomeric count: 4
pocket vol.: 586.0 Å3
d(Fe-oop): 0.104 Å
HOH chainID: D, resSeq: 227,
molecule: water