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MolNFT v1 · #115110 · protein

Structure of human parkin G319A

5C9V · E3 ubiquitin-protein ligase parkin: “Structure of human parkin G319A”. X-ray diffraction, 2 ligands (ZN, SO4), 3 pockets (best druggability 0.44). MolNFT v1 #115110 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5C9V
Type
protein
Length
306 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
E3 ubiquitin-protein ligase parkin
EC
6.3.2.-
UniProt
O60260
Ligands
ZN, SO4
Pockets
3 · best druggability 0.44

Structure

x-ray diffraction · 1 distinct chain · 19% helix, 25% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AE3 ubiquitin-protein ligase parkin (EC 6.3.2.-)protein30619% helix, 25% strandO60260

Ligands and binding sites

  • ZN · Zinc ion · metal · 8 copies · chains A
  • SO4 · Sulfate ion · ion · 6 copies · chains A
  • GOL · Glycerol · additive · 3 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1770.440.8115empty
2640.330.7613empty
3610.280.7417empty

Compared structures

  • 5C9V · Structure of human Parkin G319A · the same entry in another collection · chain A against A, TM-score 1.00
  • O60260 · AlphaFold monomer V2.0 prediction for E3 ubiquitin-protein ligase parkin (O60260) · a predicted model of the same protein · chain A against A, TM-score 0.86

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