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Ligand · A1APL

A1APL · (3R,4S)-4-methyloxolan-3-yl [(6P)-8-amino-7-fluoro-6-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)isoquinolin-3-yl]carbamate

A1APL, (3R,4S)-4-methyloxolan-3-yl [(6P)-8-amino-7-fluoro-6-(8-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)isoquinolin-3-yl]carbamate (C23 H24 F N5 O4, 453.5 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB…

Component
A1APL
Formula
C23 H24 F N5 O4
Class
ligand
Structures
1
PDB entries
1

Binding sites

A1APL in 1 structure; the first of them:

  • 9BI8 · Crystal structure of inhibitor GNE-6893 bound to HPK1 · A1APL A301 · binds LEU23, THR27, TYR28, VAL31, ALA44, LYS46, VAL75, MET91 and 13 more

Residues it binds most

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

Found with

  • NA · Sodium ion
  • DMS · Dimethyl sulfoxide

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