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TitleThe identification of highly efficacious functionalised tetrahydrocyclopenta[ c ]pyrroles as inhibitors of HBV viral replication through modulation of HBV capsid assembly.
Journal, issue, pagesRsc Med Chem, Vol. 13, Page 343-349, Year 2022
Publish dateSep 15, 2021 (structure data deposition date)
AuthorsCole, A.G. / Kultgen, S.G. / Mani, N. / Ardzinski, A. / Fan, K.Y. / Thi, E.P. / Dorsey, B.D. / Stever, K. / Chiu, T. / Tang, S. ...Cole, A.G. / Kultgen, S.G. / Mani, N. / Ardzinski, A. / Fan, K.Y. / Thi, E.P. / Dorsey, B.D. / Stever, K. / Chiu, T. / Tang, S. / Daly, O. / Phelps, J.R. / Harasym, T. / Olland, A. / Suto, R.K. / Sofia, M.J.
External linksRsc Med Chem / PubMed:35434625
MethodsX-ray diffraction
Resolution2.5 Å
Structure data

PDB-7s76:
HBV CAPSID Y132A WITH COMPOUND 10b AT 2.5A RESOLUTION
Method: X-RAY DIFFRACTION / Resolution: 2.5 Å

Chemicals

ChemComp-8EI:
(1-methyl-1H-1,2,4-triazol-3-yl)methyl {(4S)-1-[(3-chloro-4-fluorophenyl)carbamoyl]-2-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrrol-4-yl}carbamate

Source
  • hepatitis b virus genotype a
KeywordsVIRAL PROTEIN/INHIBITOR / core / VIRAL PROTEIN / inhibitor / VIRAL PROTEIN-INHIBITOR complex

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