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Ligand · VR1

VR1 · (2S)-2-({(5Z)-5-[(5-ethyl-2-furyl)methylene]-4-oxo-4,5-dihydro-1,3-thiazol-2-yl}amino)-2-(4-fluorophenyl)-N-[(4-nitrophenyl)sulfonyl]acetamide

VR1, (2S)-2-({(5Z)-5-[(5-ethyl-2-furyl)methylene]-4-oxo-4,5-dihydro-1,3-thiazol-2-yl}amino)-2-(4-fluorophenyl)-N-[(4-nitrophenyl)sulfonyl]acetamide (C24 H19 F N4 O7 S2, 558.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2…

Component
VR1
Formula
C24 H19 F N4 O7 S2
Class
ligand
Structures
2
PDB entries
1

Binding sites

VR1 in 2 structures; the first of them:

  • 2O5D · Thiazolone-acylsulfonamides as novel HCV NS5B polymerase allosteric inhibitors… · VR1 A600 · binds LEU419, ARG422, MET423, LEU474, HIS475, SER476, TYR477, ILE482 and 9 more
  • 2O5D · Thiazolone-acylsulfonamides as novel HCV NS5B polymerase allosteric inhibitors… · VR1 A600 · binds LEU419, ARG422, MET423, LEU474, HIS475, SER476, TYR477, ILE482 and 9 more

Residues it binds most

LEU 4, ARG 4, VAL 4, ALA 4, HIS 4, ILE 4, LYS 4, MET 4, SER 4, TRP 4 (residue and the binding sites it lines).

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