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Ligand · QYA

QYA · 2-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-N-(4-sulfamoylphenyl)acetamide

QYA, 2-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-N-(4-sulfamoylphenyl)acetamide (C12 H12 N4 O5 S, 324.3 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…

Component
QYA
Formula
C12 H12 N4 O5 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

QYA in 2 structures; the first of them:

  • 6VJ3 · Carbonic Anhydrase II in complex with pyrimidine-based inhibitor · QYA A302 · binds ASN67, GLU69, ILE91, GLN92, HIS94, HIS96, GLU106, HIS119 and 8 more
  • 6VJ3 · Carbonic anhydrase II in complex with pyrimidine-based inhibitor · QYA A302 · binds ASN67, GLU69, ILE91, GLN92, HIS94, HIS96, HIS119, VAL121 and 6 more

Residues it binds most

HIS 2, THR 2, VAL 2, GLU 2, ASN 2, GLN 2, ILE 2, LEU 2, PHE 2, TRP 2 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion
  • GOL · Glycerol

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