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MolNFT v1 · #146881 · protein

Crystal structure of danio rerio histone deacetylase 6 catalytic domain 2 in complex with bavarostat

6DVO · HDAC6 protein: “Crystal structure of danio rerio histone deacetylase 6 catalytic domain 2 in complex with bavarostat”. X-ray diffraction, 4 ligands (PRO, HBV, K). MolNFT v1 #146881 on GenesisL1: 3D structure, binding sites and…

PDB
6DVO
Type
protein
Length
352 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
HDAC6 protein
UniProt
A7YT55
Ligands
PRO, HBV, K, ZN

Structure

x-ray diffraction · 1 distinct chain · 43% helix, 13% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHDAC6 proteinprotein35243% helix, 13% strandA7YT55

Ligands and binding sites

  • PRO · Proline · ligand · chains A
  • HBV · 3-fluoro-N-hydroxy-4-[(methyl{[(3s,5s,7s)-tricyclo[3.3.1.1~3,7~]decan-1-yl]methyl}amino) methyl]benzamide · ligand · chains A
  • K · Potassium ion · metal · 2 copies · chains A
  • ZN · Zinc ion · metal · chains A
  • EDO · 1,2-ethanediol · additive · 8 copies · chains A

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

Compared structures

  • 6DVO · Crystal structure of Danio rerio histone deacetylase 6 catalytic domain 2 in complex with… · the same entry in another collection · chain A against A, TM-score 1.00

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