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MolNFT v1 · #105078 · protein

Crystal structure of human JMJD5 jmj-C domain

4QU1 · Lysine-specific demethylase 8: “Crystal structure of human JMJD5 jmj-C domain”. X-ray diffraction, 2 ligands (AKG, NI), 1 pocket (best druggability 0.54). MolNFT v1 #105078 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
4QU1
Type
protein
Length
236 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Lysine-specific demethylase 8
EC
1.14.11.27
UniProt
Q8N371
Ligands
AKG, NI
Pockets
1 · best druggability 0.54

Structure

x-ray diffraction · 1 distinct chain · 25% helix, 33% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ALysine-specific demethylase 8 (EC 1.14.11.27)protein23625% helix, 33% strandQ8N371

Ligands and binding sites

  • AKG · 2-oxoglutaric acid · ligand · chains A
  • NI · Nickel (II) ion · metal · chains A
  • GOL · Glycerol · additive · 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, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11210.540.8225NI, AKG

Compared structures

  • 4QU1 · Crystal structure of human JMJD5 jmj-c domain · the same entry in another collection · chain A against A, TM-score 1.00
  • Q8N371 · AlphaFold monomer V2.0 prediction for bifunctional peptidase and arginyl-hydroxylase… · a predicted model of the same protein · chain A against A, TM-score 1.00

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