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MolNFT v1 · #42336 · protein

NMR solution structure of the first phd finger domain of human autoimmune regulator (aire) in complex with histone H3(1-20CYS) peptide

2KFT: “NMR solution structure of the first phd finger domain of human autoimmune regulator (aire) in complex with…”. Solution nmr, 1 ligand (ZN). MolNFT v1 #42336 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
2KFT
Type
protein
Length
77 residues
Chains
2
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Autoimmune regulator; Histone H3
UniProt
O43918
Ligands
ZN

Structure

solution nmr · 2 distinct chains · 6% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAutoimmune regulatorprotein569% helix, 14% strandO43918
BHistone H3protein210% helix, 19% strand—

Ligands and binding sites

  • ZN · Zinc ion · metal · 2 copies · chains A

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

Interfaces

1 interface between chains.

  • A–B · 655 Ų buried · 19 hydrogen bonds · protein-protein

Compared structures

  • 2KFT · NMR Solution structure of the first PHD finger domain of human Autoimmune Regulator… · the same entry in another collection · chain A against A, TM-score 1.00
  • O43918 · AlphaFold monomer V2.0 prediction for autoimmune regulator (O43918) · a predicted model of the same protein · chain A against A, TM-score 0.79

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