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MB Sample ID: SA205470

Local Sample ID:1cCre
Subject ID:SU002225
Subject Type:Cultured cells
Subject Species:Mus musculus
Taxonomy ID:10090
Gender:Male and female

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Combined analysis:

Analysis ID AN003501 AN003502
Analysis type MS MS
Chromatography type Ion Chromatography None (Direct infusion)
Chromatography system ThermoDionexICS3000 TriVersa NanoMate
Column ThermoDionexAS11/AG11 TriVersa NanoMate
MS Type ESI ESI
MS instrument type QTRAP QTRAP
MS instrument name ABI Sciex 3200 QTrap ABI Sciex 6500 QTrap
Ion Mode NEGATIVE POSITIVE
Units mol% pmol/10E6 cells

MS:

MS ID:MS003261
Analysis ID:AN003501
Instrument Name:ABI Sciex 3200 QTrap
Instrument Type:QTRAP
MS Type:ESI
MS Comments:Mass spectrometric analysis was performed using the QTRAP 3200 (SCIEX) operated by Analyst 1.6.2. The electrospray ionization source parameters were −4,500 eV at 600°C, N2 gas pressures were 20 p.s.i. (curtaingas), 30 p.s.i. (gas1), and 20 p.s.i. (gas2), and collision gas was set to medium. The dwell time for ions was 75 ms, and scan time per cycle was 3.7 s.Scan ranges were from mass-to-charge ratio 87 to 606 (precursor ions) and mass-to-charge ratio 59 to 385 (product ions). Masstransitions (metabolite m/z mother ion / m/z daughter ion)recorded were as follows: UDP-glucose 565 / 323, glucose-1-phosphate 259 / 79, glucose-6-phosphate 259 / 97, 3-phosphoglycerate 185 / 97, phosphoenol pyruvate 167 / 79, citrate 191 / 87, isocitrate 191 / 111, malate 133 / 71, AMP 346/79, ADP 427/79, 2-oxoglutarate (aKG) 145 / 101, succinate 117 / 73, UDPNAG 606/385, Itaconate 129/85, Lactat 89/43, D-glucose 179/89, fumarate 115 / 71, E4P 199/97, ATP 427/79, UDP 404/79, G16BP 339/97 The contents of metabolites were calculated based on peak areas for precursor/product ion transitions relative to standards.
Ion Mode:NEGATIVE
  
MS ID:MS003262
Analysis ID:AN003502
Instrument Name:ABI Sciex 6500 QTrap
Instrument Type:QTRAP
MS Type:ESI
MS Comments:Mass spectrometric analysis was performed using the QTRAP 6500 (SCIEX) operated by Analyst 1.6.3. The following instrument dependent settings were used: curtain gas, 20 psi; CAD gas, medium; and interface heater temperature, 100°C. PC analysis was performed in the positive ion mode by scanning for precursors of m/z 184 at a collision energy of 35 eV. PE, PS, PG, PI, and PA measurements were performed in the positive ion mode by scanning for neutral losses of 141, 185, 189, 277, and 115 D at CE of 25 eV. The value for the declustering potential was 100 V (Özbalci et al. (2013) Methods Mol Biol 1033:3-20). Scanning was performed in a mass range of m/z 650–900 D and at a scan rate of 200 D/s. 61 MCA spectra were accumulated. Mass spectra were processed by the LipidView Software Version 1.2 (SCIEX) for identification and quantification of glycerophospholipids. Endogenous glycerophospolipids were quantified by referring their peak areas to those of the internal standards.
Ion Mode:POSITIVE
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