GL1X · GenesisL1 explorer

MolNFT v1 · #120279 · protein

Y74COX mutant of plasmodium falciparum triosephosphate isomerase

5GV4: “Y74COX mutant of plasmodium falciparum triosephosphate isomerase”. X-ray diffraction, 1 ligand (PGA), 1 pocket (best druggability 0.37). MolNFT v1 #120279 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5GV4
Type
protein
Length
245 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Triosephosphate isomerase
EC
5.3.1.1
UniProt
Q07412
Ligands
PGA
Pockets
1 · best druggability 0.37

Structure

x-ray diffraction · 1 distinct chain · 43% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATriosephosphate isomerase (EC 5.3.1.1)protein24543% helix, 16% strandQ07412

Ligands and binding sites

  • PGA · 2-phosphoglycolic acid · ligand · chains A
  • EDO · 1,2-ethanediol · additive · 5 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, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1950.370.7516empty

Compared structures

  • 5GV4 · Y74COX mutant of plasmodium falciparum triosephosphate isomerase · the same entry in another collection · chain A against A, TM-score 1.00
  • Q07412 · AlphaFold monomer V2.0 prediction for triosephosphate isomerase (Q07412) · a predicted model of the same protein · chain A against A, TM-score 0.97

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