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Ligand · TV9

TV9 · N-[(1S)-1-(pyridin-3-yl)ethyl]cyclopropanecarboxamide

TV9, N-[(1S)-1-(pyridin-3-yl)ethyl]cyclopropanecarboxamide (C11 H14 N2 O, 190.2 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds…

Component
TV9
Formula
C11 H14 N2 O
Class
ligand
Structures
2
PDB entries
2

Binding sites

TV9 in 2 structures; the first of them:

  • 7GOQ · PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3C Protease in… · TV9 A201 · binds PHE6, ALA9, ILE10, ARG84, PHE89
  • 7HNC · PanDDA analysis group deposition -- Crystal Structure of TRIM21 in complex with Z220996120 · TV9 B201 · binds TRP27, MET39, GLY40, ASP41, PHE177, ASN178, TYR179, ALA184

Residues it binds most

PHE 2, ALA 2, ARG 1, ASN 1, ASP 1, GLY 1, ILE 1, MET 1, TRP 1, TYR 1 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion
  • DMS · Dimethyl sulfoxide
  • EDO · 1,2-ethanediol

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