Ligand · 2TR

2TR · 6-amino-3-[(1S,3R)-4'-chloro-3-hydroxy-1',2'-dihydrospiro[cyclopentane-1,3'-pyrrolo[2,3-b]pyridin]-5'-yl]-2-fluoro-N,N-dimethylbenzamide

2TR, 6-amino-3-[(1S,3R)-4'-chloro-3-hydroxy-1',2'-dihydrospiro[cyclopentane-1,3'-pyrrolo[2,3-b]pyridin]-5'-yl]-2-fluoro-N,N-dimethylbenzamide (C20 H22 Cl F N4 O2, 404.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1…

Component: 2TR
Formula: C20 H22 Cl F N4 O2
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

2TR in 2 structures; the first of them:

7R9T · Crystal structure of HPK1 in complex with compound 17 · 2TR A301 · binds GLN21, LEU23, GLY24, TYR28, VAL31, ALA44, LYS46, VAL75 and 11 more
7R9T · Crystal structure of HPK1 in complex with compound 17 · 2TR A301 · binds LEU23, GLY24, TYR28, VAL31, ALA44, LYS46, MET91, GLU92 and 8 more

Residues it binds most

GLY 4, ALA 4, LEU 4, VAL 4, ASP 4, CYS 4, GLU 4, LYS 4, MET 4, PHE 4 (residue and the binding sites it lines).

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