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PyDISH No: 02513

PDB: 1thb,
chainID: B, resSeq: 147
heme type: B

distortion

Protein data

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

axial ligand #1: HIS

chainID: B,
resSeq: 92,
Coordination distance[Å]: 2.252
molecule: HEMOGLOBIN A (DEOXY) (BETA CHAIN)
Organism: Homo sapiens

List of other hemes in pdb:1thb

ID of heme Distortion Axial ligands on heme Function & structure
1thb-A-142
 sad. +0.06
ruf. -0.27
dom. -0.67
bre. -0.22
 HIS chainID: A,
resSeq: 87,
molecule: HEMOGLOBIN A (OXY) (ALPHA CHAIN)		 oxygen carrier
oligomeric count: 4
pocket vol.: 511.0 Å3
d(Fe-oop): 0.278 Å
OXY chainID: A, resSeq: 143,
molecule: OXYGEN MOLECULE
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.