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Ligand · 4BY

4BY · 5-methyl-1H-indole-2-carboxylic acid

4BY, 5-methyl-1H-indole-2-carboxylic acid (C10 H9 N O2, 175.2 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands…

Component
4BY
Formula
C10 H9 N O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

4BY in 2 structures; the first of them:

  • 5RVQ · PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in… · 4BY A201 · binds VAL3, ASN4, LYS31, PRO32, THR33, ASN87, LEU88, ALA89 and 1 more
  • 5RVQ · Pandda analysis group deposition -- crystal structure of SARS-cov-2 NSP3 macrodomain in… · 4BY A201 · binds VAL3, LYS31, PRO32, THR33, ASN87, LEU88, ALA89, LYS90

Residues it binds most

LYS 2, ASN 2, ALA 2, LEU 2, PRO 2, THR 2, VAL 2 (residue and the binding sites it lines).

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