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Ligand · IX8

IX8 · 7-methyl-N-[(2R)-1-phenoxypropan-2-yl]-3-(4-propan-2-ylphenyl)pyrazolo[1,5-a]pyrimidine-6-carboxamide

IX8, 7-methyl-N-[(2R)-1-phenoxypropan-2-yl]-3-(4-propan-2-ylphenyl)pyrazolo[1,5-a]pyrimidine-6-carboxamide (C26 H28 N4 O2, 428.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (2 PDB entries). Every binding site with its…

Component
IX8
Formula
C26 H28 N4 O2
Class
ligand
Structures
2
PDB entries
2

Binding sites

IX8 in 2 structures; the first of them:

  • 8J6P · Cryo-EM structure of the MK-6892-bound human HCAR2-Gi1 complex · IX8 R401 · binds CYS183, HIS184, THR185, PHE186, GLN187, GLU190, ALA191, LEU194 and 5 more
  • 8J6Q · Cryo-EM structure of the 3-HB and compound 9n-bound human HCAR2-Gi1 complex · IX8 R401 · binds CYS183, HIS184, THR185, PHE186, GLN187, GLU190, ALA191, LEU194 and 4 more

Residues it binds most

LEU 2, PHE 2, ALA 2, CYS 2, GLN 2, GLU 2, HIS 2, THR 2 (residue and the binding sites it lines).

Found with

  • CLR · Cholesterol
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • 3HR · (3R)-3-hydroxybutanoic acid
  • NIO · Nicotinic acid

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