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Crystal structure of AF9 yeats domain in complex with histone H3K9BU

Analyse Crystal structure of AF9 yeats domain in complex with histone H3K9BU in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6MIL
Type
protein
Length
291 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protein af-9; Histone H3K9BU
UniProt
P42568

Structure

x-ray diffraction · 3 distinct chains · 10% helix, 52% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProtein af-9protein13811% helix, 53% strandP42568
B, DHistone H3K9BUprotein70% helix, 29% strand—
CProtein af-9protein1399% helix, 53% strandP42568

Ligands and binding sites

  • PEG · Di(hydroxyethyl)ether · additive · chains A
  • MLI · Malonate ion · additive · chains C

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

Interfaces

3 interfaces between chains.

  • A–C · 801 Ų buried · 18 hydrogen bonds · protein-protein
  • A–B · 616 Ų buried · 9 hydrogen bonds · protein-protein
  • C–D · 565 Ų buried · 11 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 modified (nonstandard).

Compared structures

  • 6MIL · Crystal structure of AF9 YEATS domain in complex with histone H3K9bu · the same entry in another collection · chain A against A, TM-score 1.00
  • P42568 · AlphaFold monomer V2.0 prediction for protein af-9 (P42568) · a predicted model of the same protein · chain A against A, TM-score 0.99

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