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Ligand · 9M8

9M8 · 1-[5-[3-fluoranyl-2-[2-(1,3,5-trimethylpyrazol-4-yl) ethoxy]phenyl]-1-methyl-indazol-3-yl]-~{N},~{N}-dimethyl-methanamine

9M8, 1-[5-[3-fluoranyl-2-[2-(1,3,5-trimethylpyrazol-4-yl) ethoxy]phenyl]-1-methyl-indazol-3-yl]-~{N},~{N}-dimethyl-methanamine (C25 H30 F N5 O, 435.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
9M8
Formula
C25 H30 F N5 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

9M8 in 2 structures; the first of them:

  • 5O6J · Human NMT1 in complex with myristoyl-CoA and inhibitor IMP-1031 · 9M8 A2006 · binds VAL181, GLU182, ASP183, PHE188, ARG189, PHE190, TYR192, ASN246 and 15 more
  • 5O6J · Human NMT1 in complex with myristoyl-CoA and inhibitor imp-1031 · 9M8 A2006 · binds VAL181, GLU182, ASP183, PHE188, ARG189, PHE190, TYR192, ASN246 and 14 more

Residues it binds most

LEU 4, PHE 4, TYR 4, ASN 4, ALA 4, ARG 4, ASP 4, GLN 4, GLU 4, GLY 4 (residue and the binding sites it lines).

Found with

  • MYA · Tetradecanoyl-coa
  • MG · Magnesium ion
  • PO4 · Phosphate ion

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