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HDAC6 znf domain inhibitor - darpin (designed ankyrin repeat protein) F10

Analyse HDAC6 znf domain inhibitor - darpin (designed ankyrin repeat protein) F10 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7ZYU
Type
protein
Length
267 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Histone deacetylase 6; Designed ankyrin repeat protein F10
EC
3.5.1.98, 3.5.1.-
UniProt
Q9UBN7
Ligands
ZN
Pockets
2 · best druggability 0.71

Structure

x-ray diffraction · 2 distinct chains · 41% helix, 7% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHistone deacetylase 6 (EC 3.5.1.98, 3.5.1.-)protein10723% helix, 18% strandQ9UBN7
BDesigned ankyrin repeat protein F10protein16053% helix, 0% strand—

Ligands and binding sites

  • ZN · Zinc ion · metal · 3 copies · chains A
  • EDO · 1,2-ethanediol · additive · 3 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11670.710.8927EDO
2840.470.8220empty

Interfaces

1 interface between chains.

  • A–B · 938 Ų buried · 12 hydrogen bonds · protein-protein

Compared structures

  • 7ZYU · HDAC6 ZnF domain inhibitor - DARPin (Designed Ankyrin repeat protein) F10 · 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 0.97

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