Summary of Study ST000441

This data is available at the NIH Common Fund's National Metabolomics Data Repository (NMDR) website, the Metabolomics Workbench, https://www.metabolomicsworkbench.org, where it has been assigned Project ID PR000340. The data can be accessed directly via it's Project DOI: 10.21228/M85G6J This work is supported by NIH grant, U2C- DK119886.

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Study IDST000441
Study TitleMetabolomic Profiling of the Malaria Box Reveals Antimalarial Target Pathways
Study SummaryHere we interrogated the in vitro metabolic effects of 189 drugs (including 169 of the drug-like compounds from the Malaria Box) using ultra-high performance liquid chromatography mass-spectrometry (UHPLC-MS). The resulting metabolic fingerprints provide information on the parasite biochemical pathways affected by pharmacologic intervention and offer a critical blueprint for selecting and advancing lead compounds as next-generation antimalarial drugs. Our results reveal several major classes of metabolic disruption, which allow us to predict the mode-of-action (MoA) for many of the Malaria Box compounds.
Institute
Pennsylvania State University
Last NameLlinás
First NameManuel
AddressW126 Millenium Science Complex, University Park, PA 16802
Emailmanuel@psu.edu
Phone(814) 867-3527
Submit Date2016-07-11
Publicationsdoi: 10.1128/AAC.01224-16
Raw Data File Type(s)raw(Thermo)
Analysis Type DetailLC-MS
Release Date2016-12-22
Release Version1
Manuel Llinás Manuel Llinás
https://dx.doi.org/10.21228/M85G6J
ftp://www.metabolomicsworkbench.org/Studies/ application/zip

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Sample Preparation:

Sampleprep ID:SP000469
Sampleprep Summary:90% Methanol/10% water at 50:1 solvent/cell pellet followed by vortexing and clarification via centrifugation
Processing Method:Lysis
Processing Storage Conditions:4 C
Extract Cleanup:Clarification via centrifugation followed by nitrogen drying
Extract Storage:-80 C
Sample Resuspension:6X pellet volume of HPLC H2O
Sample Spiking:Internal Standard 13C4, 15N1-Aspartate used for sample preparation normalizer
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