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Ligand · YFG

YFG · 7-(cyclopentylamino)-5-fluoro-2-{[(trans-4-hydroxycyclohexyl)sulfanyl]methyl}quinazolin-4(3H)-one

YFG, 7-(cyclopentylamino)-5-fluoro-2-{[(trans-4-hydroxycyclohexyl)sulfanyl]methyl}quinazolin-4(3H)-one (C20 H26 F N3 O2 S, 391.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
YFG
Formula
C20 H26 F N3 O2 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

YFG in 2 structures; the first of them:

  • 7LUN · Human PARP14 (ARTD8), catalytic fragment in complex with RBN011980 · YFG A1901 · binds PHE1681, HIS1682, GLY1683, THR1684, ASP1685, SER1688, TYR1701, LYS1704 and 12 more
  • 7LUN · Human PARP14 (ARTD8), catalytic fragment in complex with RBN011980 · YFG A1901 · binds PHE1681, HIS1682, GLY1683, THR1684, ASP1685, SER1688, TYR1701, LYS1704 and 12 more

Residues it binds most

TYR 16, ALA 16, SER 16, THR 16, ASN 16, ASP 16, GLY 16, HIS 16, LEU 16, LYS 16 (residue and the binding sites it lines).

Found with

  • CL · Chloride ion
  • GOL · Glycerol

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