GL1X · GenesisL1 explorer

Ligand · 699

699 · (2S,4S,5R)-2-isobutyl-5-(2-thienyl)-1-[4-(trifluoromethyl)benzoyl]pyrrolidine-2,4-dicarboxylic acid

699, (2S,4S,5R)-2-isobutyl-5-(2-thienyl)-1-[4-(trifluoromethyl)benzoyl]pyrrolidine-2,4-dicarboxylic acid (C22 H22 F3 N O5 S, 469.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
699
Formula
C22 H22 F3 N O5 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

699 in 2 structures; the first of them:

  • 2JC0 · Crystal structure of hepatitis C virus polymerase in complex with inhibitor SB655264 · 699 A1563 · binds ARG200, ASN316, SER365, CYS366, SER367, SER368, LEU384, ARG386 and 10 more
  • 2JC0 · Crystal structure of hepatitis C virus polymerase in complex with inhibitor SB655264 · 699 A1563 · binds ARG200, ASN316, SER365, CYS366, SER367, SER368, LEU384, ARG386 and 10 more

Residues it binds most

ARG 8, SER 8, LEU 8, TYR 8, ASN 4, GLY 4, MET 8, CYS 4, GLN 4, HIS 4 (residue and the binding sites it lines).

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