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PyDISH No: 02515

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

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

chainID: D,
resSeq: 92,
Coordination distance[Å]: 2.178
molecule: HEMOGLOBIN A (DEOXY) (BETA CHAIN)
Organism: Homo sapiens

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
1thb-A-142	`sad. +0.06 ruf. -0.27 dom. -0.67 bre. -0.22`	OXY	chainID: A, resSeq: 143, molecule: OXYGEN MOLECULE
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
1thb-B-147	`sad. +0.40 ruf. +0.13 dom. -0.52 bre. -0.09`	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
1thb-C-142	`sad. +0.26 ruf. -0.35 dom. -0.67 bre. -0.11`	OXY	chainID: C, resSeq: 143, molecule: OXYGEN MOLECULE