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Ligand · F97

F97 · N-{2-(3,3-difluoropyrrolidin-1-yl)-6-[(3R)-pyrrolidin-3-yl]pyrimidin-4-yl}-1-(propan-2-yl)-1H-pyrazolo[4,3-c]pyridin-6-amine

F97, N-{2-(3,3-difluoropyrrolidin-1-yl)-6-[(3R)-pyrrolidin-3-yl]pyrimidin-4-yl}-1-(propan-2-yl)-1H-pyrazolo[4,3-c]pyridin-6-amine (C21 H26 F2 N8, 428.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (2 PDB entries).…

Component
F97
Formula
C21 H26 F2 N8
Class
ligand
Structures
2
PDB entries
2

Binding sites

F97 in 2 structures; the first of them:

  • 6CQF · Crystal structure of HPK1 in complex an inhibitor G1858 · F97 A301 · binds LEU23, GLY24, VAL31, ALA44, MET91, GLU92, PHE93, CYS94 and 5 more
  • 7R9N · Crystal structure of HPK1 in complex with GNE1858 · F97 A301 · binds LEU23, GLY24, TYR28, VAL31, ALA44, MET91, GLU92, PHE93 and 6 more

Residues it binds most

GLY 3, ALA 3, LEU 3, VAL 3, ASP 3, CYS 3, GLU 3, MET 3, PHE 3, TYR 2 (residue and the binding sites it lines).

Found with

  • EDO · 1,2-ethanediol
  • MES · 2-(N-morpholino)-ethanesulfonic acid

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