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PyDISH No: 05752

PDB: 3gqr,
chainID: H, resSeq: 148
heme type: B

distortion

Protein data

function: oxygen carrier
experiment: X-RAY DIFFRACTION
resolution: 2.4 Å

axial ligand #1: HIS

chainID: H,
resSeq: 92,
Coordination distance[Å]: 2.296
molecule: Hemoglobin subunit beta-A/B
Organism: Felis silvestris catus

axial ligand #2: HOH

chainID: H,
resSeq: 160,
Coordination distance[Å]: 2.394
molecule: water

List of other hemes in pdb:3gqr

ID of heme	Distortion	Axial ligands on heme		Function & structure
3gqr-A-143	`sad. +0.49 ruf. -0.44 dom. -0.26 bre. -0.44`	HIS	chainID: A, resSeq: 87, molecule: Hemoglobin subunit alpha	oxygen carrier oligomeric count: 4 pocket vol.: 546.0 Å³ d(Fe-oop): 0.040 Å
3gqr-A-143	`sad. +0.49 ruf. -0.44 dom. -0.26 bre. -0.44`	HOH	chainID: A, resSeq: 145, molecule: water
3gqr-B-148	`sad. +0.04 ruf. -0.45 dom. -0.33 bre. -0.31`	HIS	chainID: B, resSeq: 92, molecule: Hemoglobin subunit beta-A/B	oxygen carrier oligomeric count: 4 pocket vol.: 530.0 Å³ d(Fe-oop): 0.044 Å
3gqr-B-148	`sad. +0.04 ruf. -0.45 dom. -0.33 bre. -0.31`	HOH	chainID: B, resSeq: 151, molecule: water
3gqr-C-143	`sad. +0.43 ruf. -0.33 dom. -0.33 bre. -0.31`	HIS	chainID: C, resSeq: 87, molecule: Hemoglobin subunit alpha	oxygen carrier oligomeric count: 4 pocket vol.: 527.0 Å³ d(Fe-oop): 0.030 Å
3gqr-C-143	`sad. +0.43 ruf. -0.33 dom. -0.33 bre. -0.31`	HOH	chainID: C, resSeq: 156, molecule: water
3gqr-D-148	`sad. +0.18 ruf. -0.50 dom. -0.23 bre. -0.23`	HIS	chainID: D, resSeq: 92, molecule: Hemoglobin subunit beta-A/B	oxygen carrier oligomeric count: 4 pocket vol.: 528.0 Å³ d(Fe-oop): 0.064 Å
3gqr-D-148	`sad. +0.18 ruf. -0.50 dom. -0.23 bre. -0.23`	HOH	chainID: D, resSeq: 162, molecule: water
3gqr-E-143	`sad. +0.35 ruf. -0.46 dom. -0.19 bre. -0.35`	HIS	chainID: E, resSeq: 87, molecule: Hemoglobin subunit alpha	oxygen carrier oligomeric count: 4 pocket vol.: 567.0 Å³ d(Fe-oop): 0.137 Å
3gqr-E-143	`sad. +0.35 ruf. -0.46 dom. -0.19 bre. -0.35`	HOH	chainID: E, resSeq: 146, molecule: water
3gqr-F-148	`sad. +0.44 ruf. -0.03 dom. -0.72 bre. -0.26`	HIS	chainID: F, resSeq: 92, molecule: Hemoglobin subunit beta-A/B	oxygen carrier oligomeric count: 4 pocket vol.: 585.0 Å³ d(Fe-oop): 0.124 Å
3gqr-F-148	`sad. +0.44 ruf. -0.03 dom. -0.72 bre. -0.26`	Not assigned.
3gqr-G-143	`sad. +0.20 ruf. -0.41 dom. -0.24 bre. -0.36`	HIS	chainID: G, resSeq: 87, molecule: Hemoglobin subunit alpha	oxygen carrier oligomeric count: 4 pocket vol.: 522.0 Å³ d(Fe-oop): 0.163 Å
3gqr-G-143	`sad. +0.20 ruf. -0.41 dom. -0.24 bre. -0.36`	HOH	chainID: G, resSeq: 178, molecule: water