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Ligand · 1SI

1SI · 3-fluoranyl-~{N}-[(~{E})-(5-pyridin-2-ylsulfanylfuran-2-yl)methylideneamino]benzamide

1SI, 3-fluoranyl-~{N}-[(~{E})-(5-pyridin-2-ylsulfanylfuran-2-yl)methylideneamino]benzamide (C17 H12 F N3 O2 S, 341.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
1SI
Formula
C17 H12 F N3 O2 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

1SI in 2 structures; the first of them:

  • 7F8H · Structure-activity relationship studies of allosteric inhibitors of EYA2 tyrosine… · 1SI B601 · binds THR278, ILE279, PHE282, PHE290, TYR294, LYS296, MET308, TRP410 and 10 more
  • 7F8H · Structure-activity relationship studies of allosteric inhibitors of EYA2 tyrosine… · 1SI B601 · binds THR278, ILE279, PHE282, PHE290, TYR294, MET308, LEU417, LEU420 and 6 more

Residues it binds most

LEU 6, PHE 6, THR 6, TYR 6, TRP 6, ASP 6, HIS 6, ARG 5, ILE 5, MET 5 (residue and the binding sites it lines).

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