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Structure paper

TitleStructures of Ebola Virus Glycoprotein Complexes with Tricyclic Antidepressant and Antipsychotic Drugs.
Journal, issue, pagesJ. Med. Chem., Vol. 61, Page 4938-4945, Year 2018
Publish dateApr 10, 2018 (structure data deposition date)
AuthorsZhao, Y. / Ren, J. / Fry, E.E. / Xiao, J. / Townsend, A.R. / Stuart, D.I.
External linksJ. Med. Chem. / PubMed:29741894
MethodsX-ray diffraction
Resolution2.19 - 2.31 Å
Structure data

PDB-6g95:
Crystal structure of Ebolavirus glycoprotein in complex with thioridazine
Method: X-RAY DIFFRACTION / Resolution: 2.31 Å

PDB-6g9b:
Crystal structure of Ebolavirus glycoprotein in complex with imipramine
Method: X-RAY DIFFRACTION / Resolution: 2.26 Å

PDB-6g9i:
Crystal structure of Ebolavirus glycoprotein in complex with clomipramine
Method: X-RAY DIFFRACTION / Resolution: 2.19 Å

Chemicals

ChemComp-NAG:
2-acetamido-2-deoxy-beta-D-glucopyranose

ChemComp-GOL:
GLYCEROL

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

ChemComp-RTZ:
10-{2-[(2R)-1-methylpiperidin-2-yl]ethyl}-2-(methylsulfanyl)-10H-phenothiazine

ChemComp-HOH:
WATER

ChemComp-IXX:
3-(5H-DIBENZO[B,F]AZEPIN-5-YL)-N,N-DIMETHYLPROPAN-1-AMINE

ChemComp-CXX:
3-(3-CHLORO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N,N-DIMETHYLPROPAN-1-AMINE

Source
  • zaire ebolavirus (strain mayinga-76)
  • ebola virus - mayinga
  • zaire, 1976
  • human immunodeficiency virus 1
KeywordsVIRAL PROTEIN / Ebolavirus Glycoprotein / Thioridazine / Protein drug complex / Imipramine / Clomipramine

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