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MolNFT v1 · #136604 · protein

Crystal structure of aicarft bound to an antifolate

5UY8: “Crystal structure of aicarft bound to an antifolate”. X-ray diffraction, 3 ligands (AMZ, 8UM, MG). MolNFT v1 #136604 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5UY8
Type
protein
Length
2,356 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P31939
Ligands
AMZ, 8UM, MG

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, D—protein589—P31939

Ligands and binding sites

  • AMZ · Aminoimidazole 4-carboxamide ribonucleotide · ligand · 7 copies · chains A, B, C, D
  • 8UM · 5-[(5S)-5-ethyl-5-methyl-6-oxo-1,4,5,6-tetrahydropyridin-3-yl]-N-(6-fluoro-1-oxo-1,2-dihydroisoquinolin-7-yl)thiophene-2-sulfonamide · ligand · 4 copies · chains A, B, C, D
  • MG · Magnesium ion · metal · 4 copies · chains A, B, C, D

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

Compared structures

  • P31939 · AlphaFold monomer V2.0 prediction for bifunctional purine biosynthesis protein atic… · a predicted model of the same protein · chain A against A, TM-score 0.99

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