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MolNFT v2 · #155433 · protein

Crosslinked alpha(Ni)-beta(Fe-CO) human hemoglobin A in the T quaternary structure at 95 K: Dark

6KAH: “Crosslinked alpha(Ni)-beta(Fe-CO) human hemoglobin A in the T quaternary structure at 95 K: Dark”. X-ray diffraction at 1.45, 4 ligands (HNI, HEM, 2FU). MolNFT v2 #155433 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6KAH
Type
protein
Length
1,148 residues
Chains
8
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
1.45
Source
Homo sapiens
UniProt
P69905, P68871
Ligands
HNI, HEM, 2FU, CMO

Structure

x-ray diffraction · resolution 1.45 · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, C, E, G—protein141—P69905
B, D, F, H—protein146—P68871

Ligands and binding sites

  • HNI · Protoporphyrin IX containing ni(ii) · ligand · 4 copies · chains A, C, E, G
  • HEM · Protoporphyrin IX containing Fe · ligand · 4 copies · chains B, D, F, H
  • 2FU · But-2-enedial · ligand · 2 copies · chains B, D, F, H
  • CMO · Carbon monoxide · ion · 4 copies · chains B, D, F, H

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Compared structures

  • 6KAH · Crosslinked ALPHA(NI)-BETA(FE-co) human hemoglobin a in the T quaternary structure at 95… · the same entry in another collection · chain H against H, TM-score 1.00
  • P69905 · AlphaFold monomer V2.0 prediction for hemoglobin subunit alpha (P69905) · a predicted model of the same protein · chain G against A, TM-score 0.99

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