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MB Sample ID: SA091967

Local Sample ID:L. acidophilus_5
Subject ID:SU001331
Subject Type:Bacteria
Subject Species:Lactobacillus
Taxonomy ID:1578
Gender:Not applicable
Cell Biosource Or Supplier:American Type Culture Collection (ATCC)
Cell Strain Details:L. acidophilus (ATCC 4357), L. gasseri (ATCC 33323)

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Subject:

Subject ID:SU001331
Subject Type:Bacteria
Subject Species:Lactobacillus
Taxonomy ID:1578
Gender:Not applicable
Cell Biosource Or Supplier:American Type Culture Collection (ATCC)
Cell Strain Details:L. acidophilus (ATCC 4357), L. gasseri (ATCC 33323)

Factors:

Local Sample IDMB Sample IDFactor Level IDLevel ValueFactor Name
L. acidophilus_5SA091967FL013187data1Factor

Collection:

Collection ID:CO001325
Collection Summary:Cultured in MRS media from frozen glycerol stocks for 24 hours. Harvested, washed, and resuspended in PBS-based buffer solution. Individual cultures treated as biological replicates.
Sample Type:Bacterial cells
Storage Conditions:-80℃
Collection Tube Temp:-80C

Treatment:

Treatment ID:TR001346
Treatment Summary:No treatment. Simply a metabolomic comparison between species.

Sample Preparation:

Sampleprep ID:SP001339
Sampleprep Summary:Normalized to 75 mg/mL in PBS-based buffer solution. Metabolites extracted by protein precipitation using 8:1:1 acetonitrile:methanol:acetone. Lipids extracted using the Folch method with 4:2:1 chloroform:methanol:water.

Combined analysis:

Analysis ID AN002096 AN002097 AN002098 AN002099
Analysis type MS MS MS MS
Chromatography type Reversed phase Reversed phase HILIC HILIC
Chromatography system Thermo Dionex Ultimate 3000 Thermo Dionex Ultimate 3000 Thermo Dionex Ultimate 3000 Thermo Dionex Ultimate 3000
Column ACE Excel 2 C18-PFP (100 x 2.1mm, 2um) ACE Excel 2 C18-PFP (100 x 2.1mm, 2um) Waters Acquity BEH Amide (150 x 2.1mm,1.7um) Waters Acquity BEH Amide (150 x 2.1mm,1.7um)
MS Type ESI ESI ESI ESI
MS instrument type Orbitrap Orbitrap Orbitrap Orbitrap
MS instrument name Thermo Q Exactive Orbitrap Thermo Q Exactive Orbitrap Thermo Q Exactive Orbitrap Thermo Q Exactive Orbitrap
Ion Mode POSITIVE NEGATIVE POSITIVE NEGATIVE
Units Intensity Intensity Intensity Intensity

Chromatography:

Chromatography ID:CH001531
Chromatography Summary:Gradient elution was performed with 0.1% formic acid in water as solvent A and acetonitrile as solvent B, at a flow rate of 0.35 mL/min, as such: 0 - 3 min: 100% A, 3 - 13 min: 100% → 20% A, 13 - 16.5 min: 20% A, 16.5 - 20 min: 100% A at 0.6 mL/min (column flush & equilibration).
Instrument Name:Thermo Dionex Ultimate 3000
Column Name:ACE Excel 2 C18-PFP (100 x 2.1mm, 2um)
Column Temperature:25
Flow Rate:0.35 mL/min
Solvent A:100% water; 0.1% formic acid
Solvent B:100% acetonitrile
Chromatography Type:Reversed phase
  
Chromatography ID:CH001532
Chromatography Summary:Gradient elution was performed with 60:40 acetonitrile:water with 0.1% formic acid and 10mM ammonium formate as solvent A and 90:8:2 isopropanol:acetonitrile:water with 0.1% formic acid and 10mM ammonium formate as solvent B, at a flow rate of 0.5 mL/min, as such: 0 - 1 min: 80% A, 1 - 3 min: 80% → 70% A, 3 - 4 min: 70% → 55% A, 4 - 6 min: 55% → 40% A, 6 - 8 min: 40% → 35% A, 8 - 10 min: 35% A, 10 -15 min: 35% → 10% A, 15 - 17 min: 10% → 2% A, 17 - 18 min: 2% A, 18 - 19 min: 2% → 80% A, 19 - 23 min: 80% A (column flush & equilibration)
Instrument Name:Thermo Dionex Ultimate 3000
Column Name:Waters Acquity BEH Amide (150 x 2.1mm,1.7um)
Column Temperature:50
Flow Rate:0.5 mL/min
Solvent A:40% water/60% acetonitrile; 0.1% formic acid; 10 mM ammonium formate
Solvent B:90% isopropanol/8% acetonitrile/2% water; 0.1% formic acid; 10 mM ammonium formate
Chromatography Type:HILIC

MS:

MS ID:MS001947
Analysis ID:AN002096
Instrument Name:Thermo Q Exactive Orbitrap
Instrument Type:Orbitrap
MS Type:ESI
MS Comments:See manuscript
Ion Mode:POSITIVE
  
MS ID:MS001948
Analysis ID:AN002097
Instrument Name:Thermo Q Exactive Orbitrap
Instrument Type:Orbitrap
MS Type:ESI
MS Comments:See manuscript
Ion Mode:NEGATIVE
  
MS ID:MS001949
Analysis ID:AN002098
Instrument Name:Thermo Q Exactive Orbitrap
Instrument Type:Orbitrap
MS Type:ESI
MS Comments:See manuscript
Ion Mode:POSITIVE
  
MS ID:MS001950
Analysis ID:AN002099
Instrument Name:Thermo Q Exactive Orbitrap
Instrument Type:Orbitrap
MS Type:ESI
MS Comments:See manuscript
Ion Mode:NEGATIVE
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