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Ligand · DN2

DN2 · 3-({(2S)-2-[({(1S)-1-[({(1S)-1-[(R)-carboxy(hydroxy)methyl]-3,3-difluoropropyl}amino)carbonyl]-3-methylbutyl}amino)carbonyl]-2,3-dihydro-1H-indol-2-yl}methyl)thiophene-2-carboxylic acid

DN2, 3-({(2S)-2-[({(1S)-1-[({(1S)-1-[(R)-carboxy(hydroxy)methyl]-3,3-difluoropropyl}amino)carbonyl]-3-methylbutyl}amino)carbonyl]-2,3-dihydro-1H-indol-2-yl}methyl)thiophene-2-carboxylic acid (C26 H31 F2 N3 O7 S, 567.6 g/mol), in the MolNFT…

Component
DN2
Formula
C26 H31 F2 N3 O7 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

DN2 in 2 structures; the first of them:

  • 1W3C · Crystal structure of the Hepatitis C Virus NS3 Protease in complex with a peptidomimetic… · DN2 B1176 · binds SER42, PHE43, HIS57, ASP81, VAL132, LEU135, LYS136, GLY137 and 7 more
  • 1W3C · Crystal structure of the hepatitis C virus NS3 protease in complex with a peptidomimetic… · DN2 B1176 · binds SER42, PHE43, HIS57, ASP81, VAL132, LEU135, LYS136, GLY137 and 7 more

Residues it binds most

SER 2, ALA 2, PHE 2, ARG 2, ASP 2, CYS 2, GLY 2, HIS 2, LEU 2, LYS 2 (residue and the binding sites it lines).

Found with

  • DN1 · 3-({(2S)-2-[({(1R)-1-[({(1R)-1-[(R)-carboxy(hydroxy)methyl]-3,3-difluoropropyl}amino)carbonyl]-3-methylbutyl}amino)carb onyl]-2,3-dihydro-1H-indol-2-yl}methyl)thiophene-2-carboxylic acid

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