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PyDISH No: 02512

PDB: 1thb,
chainID: A, resSeq: 142
heme type: B

distortion

Protein data

function: oxygen carrier
experiment: X-RAY DIFFRACTION
resolution: 1.5 Å

axial ligand #1: HIS

chainID: A,
resSeq: 87,
Coordination distance[Å]: 2.281
molecule: HEMOGLOBIN A (OXY) (ALPHA CHAIN)
Organism: Homo sapiens

axial ligand #2: OXY

chainID: A,
resSeq: 143,
Coordination distance[Å]: 1.981
molecule: OXYGEN MOLECULE

List of other hemes in pdb:1thb

ID of heme Distortion Axial ligands on heme Function & structure
1thb-B-147
sad. +0.40
ruf. +0.13
dom. -0.52
bre. -0.09
HIS chainID: B,
resSeq: 92,
molecule: HEMOGLOBIN A (DEOXY) (BETA CHAIN)
oxygen carrier
oligomeric count: 4
pocket vol.: 562.0 Å3
d(Fe-oop): 0.300 Å
Not assigned.
1thb-C-142
sad. +0.26
ruf. -0.35
dom. -0.67
bre. -0.11
HIS chainID: C,
resSeq: 87,
molecule: HEMOGLOBIN A (OXY) (ALPHA CHAIN)
oxygen carrier
oligomeric count: 4
pocket vol.: 529.0 Å3
d(Fe-oop): 0.321 Å
OXY chainID: C, resSeq: 143,
molecule: OXYGEN MOLECULE
1thb-D-147
sad. +0.55
ruf. +0.21
dom. -0.53
bre. -0.04
HIS chainID: D,
resSeq: 92,
molecule: HEMOGLOBIN A (DEOXY) (BETA CHAIN)
oxygen carrier
oligomeric count: 4
pocket vol.: 557.0 Å3
d(Fe-oop): 0.290 Å
Not assigned.