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Ligand · 058

058 · 1-benzyl-5-chloro-3-(2-fluorophenyl)-1H-indole-2-carboxylic acid

058, 1-benzyl-5-chloro-3-(2-fluorophenyl)-1H-indole-2-carboxylic acid (C22 H15 Cl F N O2, 379.8 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…

Component
058
Formula
C22 H15 Cl F N O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

058 in 2 structures; the first of them:

  • 3SKH · I. Novel HCV NS5B Polymerase Inhibitors: Discovery of Indole 2- Carboxylic Acids with… · 058 A577 · binds PHE193, PRO197, ARG200, ASN316, ASP319, CYS366, SER367, SER368 and 9 more
  • 3SKH · I. novel HCV NS5B polymerase inhibitors: discovery of indole 2- carboxylic acids with… · 058 A577 · binds PHE193, PRO197, ARG200, ASN316, ASP319, CYS366, SER367, SER368 and 9 more

Residues it binds most

ASN 4, GLY 4, SER 4, TYR 4, ARG 4, ASP 4, CYS 4, GLN 4, ILE 4, LEU 4 (residue and the binding sites it lines).

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