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TitleGroup deposition for crystallographic fragment screening of Coxsackievirus A16 (G-10) 2A protease
Journal, issue, pagesTo Be Published
Publish dateNov 6, 2024 (structure data deposition date)
AuthorsLithgo, R.M. / Fairhead, M. / Koekemoer, L. / Balcomb, B.H. / Capkin, E. / Chandran, A.V. / Golding, M. / Godoy, A.S. / Aschenbrenner, J.C. / Marples, P.G. ...Lithgo, R.M. / Fairhead, M. / Koekemoer, L. / Balcomb, B.H. / Capkin, E. / Chandran, A.V. / Golding, M. / Godoy, A.S. / Aschenbrenner, J.C. / Marples, P.G. / Ni, X. / Thompson, W. / Tomlinson, C.W.E. / Wild, C. / Winokan, M. / Xavier, M.-A.E. / Fearon, D. / von Delft, F.
External linksSearch PubMed
MethodsX-ray diffraction
Resolution1.19 - 1.61 Å
Structure data

PDB-7hoc:
Group deposition for crystallographic fragment screening of Coxsackievirus A16 (G-10) 2A protease -- Crystal structure of Coxsackievirus A16 (G-10) 2A protease in complex with Z802821712 (A71EV2A-x0437)
Method: X-RAY DIFFRACTION / Resolution: 1.4 Å

PDB-7hod:
Group deposition for crystallographic fragment screening of Coxsackievirus A16 (G-10) 2A protease -- Crystal structure of Coxsackievirus A16 (G-10) 2A protease in complex with Z82176792 (A71EV2A-x0443)
Method: X-RAY DIFFRACTION / Resolution: 1.42 Å

PDB-7hoe:
Group deposition for crystallographic fragment screening of Coxsackievirus A16 (G-10) 2A protease -- Crystal structure of Coxsackievirus A16 (G-10) 2A protease in complex with Z1148747945 (A71EV2A-x0487)
Method: X-RAY DIFFRACTION / Resolution: 1.32 Å

PDB-7hof:
Group deposition for crystallographic fragment screening of Coxsackievirus A16 (G-10) 2A protease -- Crystal structure of Coxsackievirus A16 (G-10) 2A protease in complex with Z1201620232 (A71EV2A-x0514)
Method: X-RAY DIFFRACTION / Resolution: 1.3 Å

PDB-7hog:
Group deposition for crystallographic fragment screening of Coxsackievirus A16 (G-10) 2A protease -- Crystal structure of Coxsackievirus A16 (G-10) 2A protease in complex with Z1216861874 (A71EV2A-x0525)
Method: X-RAY DIFFRACTION / Resolution: 1.19 Å

PDB-7hoh:
Group deposition for crystallographic fragment screening of Coxsackievirus A16 (G-10) 2A protease -- Crystal structure of Coxsackievirus A16 (G-10) 2A protease in complex with Z32279730 (A71EV2A-x0926)
Method: X-RAY DIFFRACTION / Resolution: 1.31 Å

PDB-7hoi:
Group deposition for crystallographic fragment screening of Coxsackievirus A16 (G-10) 2A protease -- Crystal structure of Coxsackievirus A16 (G-10) 2A protease in complex with POB0140 (A71EV2A-x1247)
Method: X-RAY DIFFRACTION / Resolution: 1.61 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-DMS:
DIMETHYL SULFOXIDE / DMSO, precipitant*YM

ChemComp-K3J:
N-ethyl-6-methylpyridazin-3-amine

ChemComp-HOH:
WATER

PDB-1bf6:
PHOSPHOTRIESTERASE HOMOLOGY PROTEIN FROM ESCHERICHIA COLI

ChemComp-WKY:
N-(3-methylpyridin-4-yl)acetamide

ChemComp-NZ1:
5-methoxy-1,3-benzothiazol-2-amine

ChemComp-YYI:
5-(difluoromethoxy)pyridin-2(3H)-one

ChemComp-SO4:
SULFATE ION

PDB-1bf7:
Unknown entry

ChemComp-W34:
(3R,4S)-4-(3-methoxyphenyl)oxan-3-amine

Source
  • coxsackievirus a16
KeywordsVIRAL PROTEIN / Diamond Light Source / I03 / ASAP / Coxsackievirus A16 / crystallographic fragment screening / PanDDA / Pandda2 / XChemExplorer

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