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Ligand · OL7

OL7 · Methyl [(1S)-1-cyclohexyl-2-{[(2r,6s,12z,13as,14ar, 16AS)-2-[(7-methoxy-3-methylquinoxalin-2-yl)oxy]-14A-{[(1-methylcyclopropyl)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]amino}-2-oxoethyl]carbamate

OL7, Methyl [(1S)-1-cyclohexyl-2-{[(2r,6s,12z,13as,14ar, 16AS)-2-[(7-methoxy-3-methylquinoxalin-2-yl)oxy]-14A-{[(1-methylcyclopropyl)sulfonyl]carbamoyl}-5,16-dioxo-1,2,3,5,6,7,8,9,10,11,13A,14,14A,15,16,16A-hexadecahydrocyclopropa[e]pyrrolo…

Component
OL7
Formula
C42 H57 N7 O10 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

OL7 in 2 structures; the first of them:

  • 6PIU · Crystal structure of HCV NS3/4A D168A protease in complex with P4-P5-6 (NR03-68) · OL7 A1202 · binds GLN1041, THR1042, PHE1043, TYR1056, HIS1057, GLY1058, VAL1078, ASP1081 and 13 more
  • 6PIU · Crystal structure of HCV NS3/4A D168A protease in complex with P4-P5-6 (NR03-68) · OL7 A1202 · binds GLN1041, THR1042, PHE1043, TYR1056, HIS1057, GLY1058, VAL1078, ASP1081 and 12 more

Residues it binds most

SER 2, ALA 2, ARG 2, GLY 2, PHE 2, VAL 2, ASP 2, GLN 2, HIS 2, ILE 2 (residue and the binding sites it lines).

Found with

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

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