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TitleTargeting Trypanosoma brucei FPPS by Fragment-based drug discovery
Journal, issue, pagesThesis, Year 2019
Publish dateMar 19, 2019 (structure data deposition date)
AuthorsMuenzker, L. / Wolfgang, J.
External linksThesis / Search PubMed
MethodsX-ray diffraction
Resolution2.1 - 2.33 Å
Structure data

PDB-6r37:
T. brucei FPPS in complex with 2-(5-chlorobenzo[b]thiophen-3-yl)acetic acid
Method: X-RAY DIFFRACTION / Resolution: 2.1 Å

PDB-6r38:
T. brucei FPPS in complex with 2-(2,5-dichlorobenzo[b]thiophen-3-yl)acetic acid
Method: X-RAY DIFFRACTION / Resolution: 2.33 Å

Chemicals

ChemComp-3N2:
(5-chloro-1-benzothiophen-3-yl)acetic acid

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

ChemComp-JQE:
2-[2,5-bis(chloranyl)-1-benzothiophen-3-yl]ethanoic acid

ChemComp-HOH:
WATER

Source
  • trypanosoma brucei (eukaryote)
KeywordsTRANSFERASE / sterol biosynthesis / farnesyl diphosphate synthase / Trypanosoma brucei / homodimer

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