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MolNFT v1 · #88438 · protein

Crystal structure of human BAZ2B in complex with fragment-2 N09594

4CUQ · Bromodomain adjacent to zinc finger domain protein 2B: “Crystal structure of human BAZ2B in complex with fragment-2 N09594”. X-ray diffraction, 1 ligand (5K3), 1 pocket (best druggability 0.46). MolNFT v1 #88438 on GenesisL1: 3D…

PDB
4CUQ
Type
protein
Length
115 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Bromodomain adjacent to zinc finger domain protein 2B
UniProt
Q9UIF8
Ligands
5K3
Pockets
1 · best druggability 0.46

Structure

x-ray diffraction · 1 distinct chain · 63% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ABromodomain adjacent to zinc finger domain protein 2Bprotein11563% helix, 0% strandQ9UIF8

Ligands and binding sites

  • 5K3 · 4-[(3S)-3-hydroxy-3-methoxypropyl]phenol · 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
1740.460.82165K3

Compared structures

  • 4CUQ · Crystal structure of human BAZ2B in complex with fragment-2 N09594 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9UIF8 · 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 0.92

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