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Ligand · 9XJ

9XJ · 3-(3-chlorophenoxy)-1-[(piperidin-4-yl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine

9XJ, 3-(3-chlorophenoxy)-1-[(piperidin-4-yl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine (C17 H19 Cl N6 O, 358.8 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues within 4.5…

Component
9XJ
Formula
C17 H19 Cl N6 O
Class
ligand
Structures
1
PDB entries
1

Binding sites

9XJ in 1 structure; the first of them:

  • 5W80 · Toxoplasma gondii CDPK1 in complex with inhibitor gxj-237 · 9XJ A601 · binds LEU57, LYS59, VAL65, ALA78, LYS80, MET112, LEU126, GLU129 and 8 more

Residues it binds most

LEU 1, GLU 1, LYS 1, VAL 1, ALA 1, ASP 1, ILE 1, MET 1, TYR 1 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion

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