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Ligand · 22K

22K · 5-[(1R,3S)-3-aminocyclohexyl]-6-bromo-3-(1-methyl-1H-pyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine

22K, 5-[(1R,3S)-3-aminocyclohexyl]-6-bromo-3-(1-methyl-1H-pyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine (C16 H20 Br N7, 390.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
22K
Formula
C16 H20 Br N7
Class
ligand
Structures
2
PDB entries
1

Binding sites

22K in 2 structures; the first of them:

  • 3OT3 · X-ray crystal structure of compound 22k bound to human Chk1 kinase domain · 22K A1 · binds LEU15, GLY16, GLU17, VAL23, ALA36, LYS38, VAL68, LEU84 and 10 more
  • 3OT3 · X-ray crystal structure of compound 22K bound to human CHK1 kinase domain · 22K A1 · binds LEU15, GLY16, GLU17, VAL23, ALA36, LYS38, VAL68, LEU84 and 10 more

Residues it binds most

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

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