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PyDISH No: 01888

PDB: 1nqp,
chainID: C, resSeq: 544
heme type: B

distortion

Protein data

function: oxygen carrier
experiment: X-RAY DIFFRACTION
resolution: 1.73 Å

axial ligand #1: HIS

chainID: C,
resSeq: 87,
Coordination distance[Å]: 2.213
molecule: Hemoglobin alpha chain
Organism: Homo sapiens

axial ligand #2: CYN

chainID: C,
resSeq: 550,
Coordination distance[Å]: 2.253
molecule: CYANIDE ION

List of other hemes in pdb:1nqp

ID of heme Distortion Axial ligands on heme Function & structure
1nqp-A-144
sad. +0.12
ruf. -0.08
dom. -0.10
bre. -0.28
HIS chainID: A,
resSeq: 87,
molecule: Hemoglobin alpha chain
oxygen carrier
oligomeric count: 4
pocket vol.: 548.0 Å3
d(Fe-oop): 0.025 Å
CYN chainID: A, resSeq: 150,
molecule: CYANIDE ION
1nqp-B-348
sad. +0.07
ruf. -0.07
dom. -0.10
bre. -0.33
HIS chainID: B,
resSeq: 92,
molecule: Hemoglobin beta chain
oxygen carrier
oligomeric count: 4
pocket vol.: 581.0 Å3
d(Fe-oop): 0.030 Å
CYN chainID: B, resSeq: 350,
molecule: CYANIDE ION
1nqp-D-748
sad. +0.09
ruf. -0.04
dom. -0.09
bre. -0.31
HIS chainID: D,
resSeq: 92,
molecule: Hemoglobin beta chain
oxygen carrier
oligomeric count: 4
pocket vol.: 565.0 Å3
d(Fe-oop): 0.025 Å
CYN chainID: D, resSeq: 750,
molecule: CYANIDE ION