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Ligand · MI5

MI5 · N-(3-methylisothiazol-5-yl)-3-(1-methyl-1H-pyrazol-4-yl)-5-[(3R)-piperidin-3-yl]pyrazolo[1,5-a]pyrimidin-7-amine

MI5, N-(3-methylisothiazol-5-yl)-3-(1-methyl-1H-pyrazol-4-yl)-5-[(3R)-piperidin-3-yl]pyrazolo[1,5-a]pyrimidin-7-amine (C19 H22 N8 S, 394.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
MI5
Formula
C19 H22 N8 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

MI5 in 2 structures; the first of them:

  • 3OT8 · X-ray crystal structure of compound 17r bound to human Chk1 kinase domain · MI5 A1 · binds LEU15, GLY16, GLU17, VAL23, ALA36, LYS38, VAL68, LEU84 and 10 more
  • 3OT8 · X-ray crystal structure of compound 17R bound to human CHK1 kinase domain · MI5 A1 · binds LEU15, GLY16, GLU17, VAL23, ALA36, LYS38, VAL68, LEU84 and 10 more

Residues it binds most

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

Found with

  • GOL · Glycerol

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