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Ligand · 9FC

9FC · 6-{[(1R,2S)-2-aminocyclohexyl]amino}-5-cyano-2-[(3-methylphenyl)amino]pyridine-3-carboxamide

9FC, 6-{[(1R,2S)-2-aminocyclohexyl]amino}-5-cyano-2-[(3-methylphenyl)amino]pyridine-3-carboxamide (C20 H24 N6 O, 364.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
9FC
Formula
C20 H24 N6 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

9FC in 2 structures; the first of them:

  • 6JMF · Crystal structure of human tyrosine-protein kinase Fes/Fps in complex with compound 4 · 9FC A903 · binds ILE567, GLY568, ARG569, VAL575, ALA588, LYS590, GLU607, VAL620 and 12 more
  • 6JMF · Crystal structure of human tyrosine-protein kinase FES/FPS in complex with compound 4 · 9FC A903 · binds ILE567, ARG569, ALA588, LYS590, GLU607, VAL620, MET636, GLU637 and 10 more

Residues it binds most

VAL 2, ARG 2, ASP 2, GLU 2, LEU 2, GLY 2, ALA 2, ASN 2, GLN 2, ILE 2 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion

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