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MolNFT v1 · #145108 · protein

Crystal structure of fragment 3-(3-methyl-4-oxo-3,4-dihydroquinazolin- 2-YL)PROPANOIC acid bound in the ubiquitin binding pocket of the HDAC6 zinc-finger domain

6CED: “Crystal structure of fragment 3-(3-methyl-4-oxo-3,4-dihydroquinazolin- 2-YL)PROPANOIC acid bound in the…”. X-ray diffraction, 3 ligands (EYA, ZN, UNX). MolNFT v1 #145108 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6CED
Type
protein
Length
99 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q9UBN7
Ligands
EYA, ZN, UNX

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein99—Q9UBN7

Ligands and binding sites

  • EYA · 3-(3-methyl-4-oxo-3,4-dihydroquinazolin-2-yl)propanoic acid · ligand · chains A
  • ZN · Zinc ion · metal · 3 copies · chains A
  • UNX · Unknown atom or ion · ion · chains A

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

Compared structures

  • 6CED · Crystal structure of fragment 3-(3-Methyl-4-oxo-3,4-dihydroquinazolin-2-yl)propanoic acid… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9UBN7 · AlphaFold monomer V2.0 prediction for histone deacetylase 6 (Q9UBN7) · a predicted model of the same protein · chain A against A, TM-score 0.99

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