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Histone fold heterodimer of the chromatin accessibility complex

Analyse Histone fold heterodimer of the chromatin accessibility complex in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2BYK
Type
protein
Length
319 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Chrac-16; Chrac-14
UniProt
Q9V452, Q9V444
Ligands
SO4
Pockets
2 · best druggability 0.66

Structure

x-ray diffraction · 4 distinct chains · 65% helix, 3% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AChrac-16protein7254% helix, 3% strandQ9V452
BChrac-14protein8970% helix, 2% strandQ9V444
CChrac-16protein6665% helix, 3% strandQ9V452
DChrac-14protein9268% helix, 2% strandQ9V444

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 3 copies · chains A, B, C, D

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

Pockets

2 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12910.660.8246empty
22900.570.7742empty

Interfaces

6 interfaces between chains.

  • C–D · 1845 Ų buried · 9 hydrogen bonds · protein-protein
  • A–B · 1762 Ų buried · 9 hydrogen bonds · protein-protein
  • A–C · 525 Ų buried · 8 hydrogen bonds · protein-protein
  • B–D · 447 Ų buried · 3 hydrogen bonds · protein-protein
  • A–D · 426 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 2BYK · Histone fold heterodimer of the Chromatin Accessibility Complex · the same entry in another collection · chain D against D, TM-score 1.00
  • Q9V444 · AlphaFold monomer V2.0 prediction for DNA polymerase epsilon subunit 3 (Q9V444) · a predicted model of the same protein · chain B against A, TM-score 0.98
  • Q9V452 · AlphaFold monomer V2.0 prediction for chromatin accessibility complex 16KD protein… · a predicted model of the same protein · chain C against A, TM-score 0.89

Analyse

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