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Ligand · TJY

TJY · 2-oxo-1,2-dihydroquinazoline-4-carboxylic acid

TJY, 2-oxo-1,2-dihydroquinazoline-4-carboxylic acid (C9 H6 N2 O3, 190.2 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it binds most and the…

Component
TJY
Formula
C9 H6 N2 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

TJY in 2 structures; the first of them:

  • 6W8M · Co-crystal structures of CHIKV nsP3 macrodomain with pyrimidone fragments · TJY A201 · binds ALA22, ALA23, ASN24, ASP31, ALA68, VAL69, GLY70, LEU108 and 7 more
  • 6W8M · Co-crystal structures of chikv NSP3 macrodomain with pyrimidone fragments · TJY A201 · binds ALA22, ALA23, ALA68, VAL69, GLY70, LEU108, LEU109, SER110 and 4 more

Residues it binds most

ALA 8, GLY 8, LEU 8, VAL 8, SER 8, THR 8, TYR 8, ASN 6, ASP 5 (residue and the binding sites it lines).

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