GL1X · GenesisL1 explorer

Ligand · 9NU

9NU · (2S,4S)-N-methyl-4-[[(2S,3R)-3-[(2-methylpropan-2-yl)oxy]-2-[[4-(pyrazol-1-ylmethyl)phenyl]carbonylamino]butanoyl]amino]-1-(phenylcarbonyl)pyrrolidine-2-carboxamide

9NU, (2S,4S)-N-methyl-4-[[(2S,3R)-3-[(2-methylpropan-2-yl)oxy]-2-[[4-(pyrazol-1-ylmethyl)phenyl]carbonylamino]butanoyl]amino]-1-(phenylcarbonyl)pyrrolidine-2-carboxamide (C32 H40 N6 O5, 588.7 g/mol), in the MolNFT structures on GenesisL1…

Component
9NU
Formula
C32 H40 N6 O5
Class
ligand
Structures
1
PDB entries
1

Binding sites

9NU in 1 structure; the first of them:

  • 5G0W · InhA in complex with a DNA encoded library hit · 9NU B1271 · binds ILE16, PHE41, ARG43, GLY96, PHE97, MET98, PRO99, GLN100 and 13 more

Residues it binds most

MET 2, PHE 2, ILE 2, LYS 2, ALA 1, GLN 2, GLY 2, TYR 2, ARG 1, LEU 1 (residue and the binding sites it lines).

Found with

  • NAD · Nicotinamide-adenine-dinucleotide
  • MG · Magnesium ion

GL1X is a live explorer of the GenesisL1 blockchain. Turn on JavaScript for search, charts and interactive views.