GL1X · GenesisL1 explorer

MolNFT v1 · #93925 · protein

Quinolinate synthase from pyrococcus furiosus

4HHE · Quinolinate synthase a: “Quinolinate synthase from pyrococcus furiosus”. X-ray diffraction, 1 ligand (CL), 1 pocket (best druggability 0.59). MolNFT v1 #93925 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
4HHE
Type
protein
Length
297 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Quinolinate synthase a
EC
2.5.1.72
UniProt
Q8TZL3
Ligands
CL
Pockets
1 · best druggability 0.59

Structure

x-ray diffraction · 1 distinct chain · 43% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AQuinolinate synthase a (EC 2.5.1.72)protein29743% helix, 15% strandQ8TZL3

Ligands and binding sites

  • CL · Chloride ion · ion · 2 copies · 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
14530.590.7569CL

Compared structures

  • 4HHE · Quinolinate synthase from Pyrococcus furiosus · the same entry in another collection · chain A against A, TM-score 1.00
  • Q8TZL3 · AlphaFold monomer V2.0 prediction for quinolinate synthase a (Q8TZL3) · a predicted model of the same protein · chain A against A, TM-score 0.66

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