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Crystal structure of daxx N-terminal four-helix bundle domain (4HB) in complex with atrx

Analyse Crystal structure of daxx N-terminal four-helix bundle domain (4HB) in complex… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5Y6O
Type
protein
Length
947 residues
Chains
9
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Death domain-associated protein 6,TRANSCRIPTIONAL regulator atrx
EC
3.6.4.12
UniProt
Q9UER7, P46100
Pockets
12 · best druggability 0.79

Structure

x-ray diffraction · 8 distinct chains · 75% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADeath domain-associated protein 6,TRANSCRIPTIONAL regulator atrx (EC 3.6.4.12)protein10576% helix, 0% strandQ9UER7, P46100
BDeath domain-associated protein 6,TRANSCRIPTIONAL regulator atrx (EC 3.6.4.12)protein10576% helix, 2% strandQ9UER7, P46100
CDeath domain-associated protein 6,TRANSCRIPTIONAL regulator atrx (EC 3.6.4.12)protein10671% helix, 0% strandQ9UER7, P46100
D, EDeath domain-associated protein 6,TRANSCRIPTIONAL regulator atrx (EC 3.6.4.12)protein10873% helix, 0% strandQ9UER7, P46100
FDeath domain-associated protein 6,TRANSCRIPTIONAL regulator atrx (EC 3.6.4.12)protein10475% helix, 0% strandQ9UER7, P46100
GDeath domain-associated protein 6,TRANSCRIPTIONAL regulator atrx (EC 3.6.4.12)protein10572% helix, 0% strandQ9UER7, P46100
HDeath domain-associated protein 6,TRANSCRIPTIONAL regulator atrx (EC 3.6.4.12)protein10381% helix, 0% strandQ9UER7, P46100
IDeath domain-associated protein 6,TRANSCRIPTIONAL regulator atrx (EC 3.6.4.12)protein10374% helix, 0% strandQ9UER7, P46100

Pockets

12 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110820.790.81106empty
23250.720.8441empty
33420.680.8246empty
45460.630.7550empty
52980.550.7531empty

Interfaces

15 interfaces between chains.

  • G–I · 906 Ų buried · 8 hydrogen bonds · protein-protein
  • A–B · 899 Ų buried · 9 hydrogen bonds · protein-protein
  • D–E · 873 Ų buried · 8 hydrogen bonds · protein-protein
  • D–F · 872 Ų buried · 5 hydrogen bonds · protein-protein
  • G–H · 866 Ų buried · 10 hydrogen bonds · protein-protein

Compared structures

  • 5Y6O · Crystal structure of DAXX N-terminal four-helix bundle domain (4HB) in complex with ATRX · the same entry in another collection · chain I against I, TM-score 1.00
  • Q9UER7 · AlphaFold monomer V2.0 prediction for death domain-associated protein 6 (Q9UER7) · a predicted model of the same protein · chain F against A, TM-score 0.79

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