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MB Sample ID: SA218859

Local Sample ID:IL03_2_12_CETOF
Subject ID:SU002371
Subject Type:Cultured cells
Subject Species:Homo sapiens + Leishmania donovani
Taxonomy ID:9606 and 5661
Genotype Strain:Human: PBMCs from 7 human donors. L. donovani: MHOM/IN/82/Patra1 and MHOM/ET/1967/Hu3

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Combined analysis:

Analysis ID AN003734 AN003735 AN003736 AN003737
Analysis type MS MS MS MS
Chromatography type CE Reversed phase Reversed phase Reversed phase
Chromatography system Agilent 7100 CE Agilent 1200 Agilent 1200 Agilent 1290 Infinity
Column bare-fused silica capillary (96 cm,50um),Agilent Technologies Agilent Zorbax Extend C18 RRHT (50 x 2.1mm,1.8 um) Agilent Zorbax Extend C18 RRHT (50 x 2.1mm,1.8 um) Agilent Zorbax RRHD SB-C18 (100 x 2.1mm,1.8um)
MS Type ESI ESI ESI ESI
MS instrument type TOF QTOF QTOF Triple quadrupole
MS instrument name Agilent 6224 TOF Agilent 6545 QTOF Agilent 6545 QTOF Agilent 6460 QQQ
Ion Mode POSITIVE POSITIVE NEGATIVE NEGATIVE
Units Abundances Abundances Abundances Normalized abundances

MS:

MS ID:MS003482
Analysis ID:AN003734
Instrument Name:Agilent 6224 TOF
Instrument Type:TOF
MS Type:ESI
MS Comments:mass range mz 68 to 1000 mass correction mz 121.0509 and 922.0098 mass calibrators Acq mode full scan AMH Profinder B.08.00 for feature deconvolution CMM Batch Search and in house library of standards with RMT
Ion Mode:POSITIVE
Capillary Voltage:3500 V
Dry Gas Flow:10 L/min
Dry Gas Temp:200 ºC
Fragment Voltage:125 V
Nebulizer:10 psi
Octpole Voltage:750 V
  
MS ID:MS003483
Analysis ID:AN003735
Instrument Name:Agilent 6545 QTOF
Instrument Type:QTOF
MS Type:ESI
MS Comments:full MS: mass range mz 50 to 3000 mass correction mz 121.0509 and 922.0098 mass calibrators iterative MSMS of pooled samples isolation width = 1.3 Da CE with slope and offset of 3.8 and 4.6, respectively AMH Profinder B.08.00 for feature deconvolution CMM Batch Search and in house library of standards with RMT AMH LipidAnnotator for in silico anotation of MSMS spectra
Ion Mode:POSITIVE
Capillary Voltage:4000 V
Dry Gas Flow:12 L/min
Dry Gas Temp:250 ºC
Fragment Voltage:125 V
Nebulizer:52 psi
Octpole Voltage:750 V
  
MS ID:MS003484
Analysis ID:AN003736
Instrument Name:Agilent 6545 QTOF
Instrument Type:QTOF
MS Type:ESI
MS Comments:full MS: mass range mz 50 to 3000 mass correction mz 121.0509 and 922.0098 mass calibrators iterative MSMS of pooled samples isolation width = 1.3 Da CE with slope and offset of 3.8 and 4.6, respectively AMH Profinder B.08.00 for feature deconvolution CMM Batch Search and in house library of standards with RMT AMH LipidAnnotator for in silico anotation of MSMS spectra
Ion Mode:NEGATIVE
Capillary Voltage:4000 V
Dry Gas Flow:12 L/min
Dry Gas Temp:250 ºC
Fragment Voltage:125 V
Nebulizer:52 psi
Octpole Voltage:750 V
  
MS ID:MS003485
Analysis ID:AN003737
Instrument Name:Agilent 6460 QQQ
Instrument Type:Triple quadrupole
MS Type:ESI
MS Comments:MRM isolation width narrow 1.3 Da AMH Quantitative Analysis (Quant My Way) for targeted data integration cycle time = 650 ms MRM repeats = 3 nozzle voltage = 500 V
Ion Mode:NEGATIVE
Capillary Voltage:2000 V
Dry Gas Flow:12 L/min
Dry Gas Temp:325 ºC
Nebulizer:45 psi
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