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Ligand · LX6

LX6 · 2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile

LX6, 2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile (C9 H10 N2 S, 178.2 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it binds…

Component
LX6
Formula
C9 H10 N2 S
Class
ligand
Structures
1
PDB entries
1

Binding sites

LX6 in 1 structure; the first of them:

  • 7U8H · Discovery of a KRAS G12V Inhibitor in vivo Tool Compound starting from an HSQC-NMR based… · LX6 A204 · binds VAL9, GLY60, GLN61, GLU62, GLU63, TYR64, ARG68, ASP69 and 6 more

Residues it binds most

ARG 2, GLU 2, TYR 2, VAL 2, GLN 2, ASP 2, ILE 2, MET 2, GLY 1, PHE 1 (residue and the binding sites it lines).

Found with

  • 2XO · 1H-benzimidazol-2-ylmethanethiol
  • GDP · Guanosine-5'-diphosphate
  • MG · Magnesium ion

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