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BAZ2A bromodomain in complex with triazole compound MS04

Analyse BAZ2A bromodomain in complex with triazole compound MS04 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7B7B
Type
protein
Length
105 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Bromodomain adjacent to zinc finger domain protein 2A
UniProt
Q9UIF9
Ligands
T1B
Pockets
1 · best druggability 0.45

Structure

x-ray diffraction · 1 distinct chain · 66% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ABromodomain adjacent to zinc finger domain protein 2Aprotein10566% helix, 0% strandQ9UIF9

Ligands and binding sites

  • T1B · 5-ethyl-2-(3-methyl-1,2,3-triazol-4-yl)-1~{H}-benzimidazole · ligand · chains A

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

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1790.450.8119T1B

Compared structures

  • 7B7B · BAZ2A bromodomain in complex with triazole compound MS04 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9UIF9 · AlphaFold monomer V2.0 prediction for bromodomain adjacent to zinc finger domain protein… · a predicted model of the same protein · chain A against A, TM-score 0.95

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