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Crystal structure of the chromodomain-ATPase portion of the yeast CHD1 chromatin remodeler

Analyse Crystal structure of the chromodomain-ATPase portion of the yeast CHD1… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3MWY
Type
protein
Length
696 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Chromo domain-containing protein 1
EC
3.6.1.-
UniProt
P32657
Ligands
AGS
Pockets
14 · best druggability 0.79

Structure

x-ray diffraction · 1 distinct chain · 41% helix, 14% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
WChromo domain-containing protein 1 (EC 3.6.1.-)protein69641% helix, 14% strandP32657

Ligands and binding sites

  • AGS · Phosphothiophosphoric acid-adenylate ester · ligand · chains W

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

Pockets

14 pockets found on a 1 Å grid, 7 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11990.790.9336empty
27640.700.7753AGS
3620.630.9215empty
41390.630.8623empty
53330.620.7935empty

Compared structures

  • 3MWY · Crystal structure of the chromodomain-ATPase portion of the yeast Chd1 chromatin remodeler · the same entry in another collection · chain W against W, TM-score 1.00
  • P32657 · AlphaFold monomer V2.0 prediction for chromo domain-containing protein 1 (P32657) · a predicted model of the same protein · chain W against A, TM-score 0.68

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