GL1X · GenesisL1 explorer

Ligand · ZJY

ZJY · [1-(trifluoromethyl)cyclopropyl]methyl {(2R,4S,6S,12Z, 13as,14ar,16as)-2-[(7-methoxy-3-methylquinoxalin-2-yl)oxy]-14A-[(1-methylcyclopropane-1-sulfonyl) carbamoyl]-5,16-dioxo-1,2,3,5,6,7,8,9,10,11,13A,14, 14A,15,16,16A-hexadecahydrocyclopropa[e]pyrrolo[1,2-a][1,4]diazacyclopentadecin-6-yl}carbamate

ZJY, [1-(trifluoromethyl)cyclopropyl]methyl {(2R,4S,6S,12Z, 13as,14ar,16as)-2-[(7-methoxy-3-methylquinoxalin-2-yl)oxy]-14A-[(1-methylcyclopropane-1-sulfonyl) carbamoyl]-5,16-dioxo-1,2,3,5,6,7,8,9,10,11,13A,14…

Component
ZJY
Formula
C38 H47 F3 N6 O9 S
Class
ligand
Structures
4
PDB entries
2

Binding sites

ZJY in 4 structures; the first of them:

  • 7MM6 · Crystal structure of HCV NS3/4A protease in complex with NR02-49 · ZJY A1202 · binds GLN1041, THR1042, PHE1043, TYR1056, HIS1057, GLY1058, VAL1078, ASP1081 and 13 more
  • 7MMH · Crystal structure of HCV NS3/4A D168A protease in complex with NR02-49 · ZJY A1202 · binds GLN1041, THR1042, PHE1043, TYR1056, HIS1057, GLY1058, VAL1078, ASP1081 and 13 more
  • 7MM6 · Crystal structure of HCV NS3/4A protease in complex with NR02-49 · ZJY A1202 · binds GLN1041, THR1042, PHE1043, TYR1056, HIS1057, GLY1058, VAL1078, ASP1081 and 13 more
  • 7MMH · Crystal structure of HCV NS3/4A D168A protease in complex with NR02-49 · ZJY A1202 · binds GLN1041, THR1042, PHE1043, TYR1056, HIS1057, GLY1058, VAL1078, ASP1081 and 13 more

Residues it binds most

ALA 4, ARG 4, GLY 4, PHE 4, SER 4, VAL 4, ASP 4, GLN 4, HIS 4, ILE 4 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion
  • SO4 · Sulfate ion
  • EDO · 1,2-ethanediol

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