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Structure paper

TitleOxamniquine derivatives overcome Praziquantel treatment limitations for Schistosomiasis.
Journal, issue, pagesPlos Pathog., Vol. 19, Page e1011018-e1011018, Year 2023
Publish dateAug 22, 2022 (structure data deposition date)
AuthorsAlwan, S.N. / Taylor, A.B. / Rhodes, J. / Tidwell, M. / McHardy, S.F. / LoVerde, P.T.
External linksPlos Pathog. / PubMed:37428793
MethodsX-ray diffraction
Resolution1.33 - 1.4 Å
Structure data

PDB-8e5q:
Schistosoma mansoni (Blood Fluke) Sulfotransferase/CIDD-0150303 Complex
Method: X-RAY DIFFRACTION / Resolution: 1.33 Å

PDB-8e5r:
Schistosoma mansoni (Blood Fluke) Sulfotransferase/CIDD-0150610 Complex
Method: X-RAY DIFFRACTION / Resolution: 1.4 Å

Chemicals

ChemComp-UMI:
[2-(dihydroxyamino)-4-({[(3R)-1-[(1H-indol-3-yl)methyl]-3-{[3-(trifluoromethyl)phenyl]methyl}pyrrolidin-3-yl]methyl}amino)phenyl]methanol

ChemComp-A3P:
ADENOSINE-3'-5'-DIPHOSPHATE

ChemComp-HOH:
WATER

ChemComp-ULX:
[4-({[(3R)-1-[(1H-indol-3-yl)methyl]-3-{[4-(trifluoromethyl)phenyl]methyl}pyrrolidin-3-yl]methyl}amino)-3-nitrophenyl]methanol

Source
  • schistosoma mansoni (invertebrata)
KeywordsTRANSFERASE / SULFOTRANSFERASE / PARASITE / DRUG RESISTANCE

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