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Ligand · 5N9

5N9 · ~{N}-[[2-(3-chloranyl-4-propan-2-yloxy-phenyl) pyrimidin-5-yl]methyl]-2-(trifluoromethyl)pyridin-4-amine

5N9, ~{N}-[[2-(3-chloranyl-4-propan-2-yloxy-phenyl) pyrimidin-5-yl]methyl]-2-(trifluoromethyl)pyridin-4-amine (C20 H18 Cl F3 N4 O, 422.8 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
5N9
Formula
C20 H18 Cl F3 N4 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

5N9 in 2 structures; the first of them:

  • 7P4U · Crystal structure of PqsR (MvfR) ligand-binding domain in complex with… · 5N9 A401 · binds ALA102, ILE149, ALA168, HIS184, SER185, ILE186, LEU189, LEU207 and 11 more
  • 7P4U · Crystal structure of pqsr (mvfr) ligand-binding domain in complex with… · 5N9 A401 · binds ALA102, ILE149, ALA168, HIS184, SER185, ILE186, LEU189, LEU207 and 11 more

Residues it binds most

ILE 2, ALA 2, LEU 2, SER 2, HIS 2, PHE 2, PRO 2, THR 2, TRP 2, TYR 2 (residue and the binding sites it lines).

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