<HashMap><database>MetaboLights</database><file_versions><headers><Content-Type>application/xml</Content-Type></headers><body><files><Tabular>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14550/m_MTBLS14550_LC-MS_positive_reverse-phase_v2_maf.tsv</Tabular><Tabular>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14550/m_MTBLS14550_LC-MS_negative_reverse-phase_v2_maf.tsv</Tabular><Txt>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14550/s_MTBLS14550.txt</Txt><Txt>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14550/i_Investigation.txt</Txt><Txt>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14550/a_MTBLS14550_LC-MS_positive_reverse-phase.txt</Txt><Txt>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14550/a_MTBLS14550_LC-MS_negative_reverse-phase.txt</Txt><Mzxml>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14550/FILES/DERIVED_FILES/POS/Pos_QC2.mzXML</Mzxml><Mzxml>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14550/FILES/DERIVED_FILES/POS/Pos_MRS2.mzXML</Mzxml><Mzxml>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14550/FILES/DERIVED_FILES/NEG/Neg_QC2.mzXML</Mzxml><Mzxml>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14550/FILES/DERIVED_FILES/NEG/Neg_KD3.mzXML</Mzxml><Mzxml>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14550/FILES/DERIVED_FILES/NEG/Neg_MRS2.mzXML</Mzxml><Mzxml>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14550/FILES/DERIVED_FILES/POS/Pos_KD1.mzXML</Mzxml><Mzxml>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14550/FILES/DERIVED_FILES/POS/Pos_QC4.mzXML</Mzxml><Mzxml>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14550/FILES/DERIVED_FILES/POS/Pos_MRS3.mzXML</Mzxml><Mzxml>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14550/FILES/DERIVED_FILES/NEG/Neg_KD1.mzXML</Mzxml><Mzxml>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14550/FILES/DERIVED_FILES/NEG/Neg_QC4.mzXML</Mzxml><Mzxml>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14550/FILES/DERIVED_FILES/POS/Pos_KD3.mzXML</Mzxml><Mzxml>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14550/FILES/DERIVED_FILES/POS/Pos_KD2.mzXML</Mzxml><Mzxml>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14550/FILES/DERIVED_FILES/NEG/Neg_QC3.mzXML</Mzxml><Mzxml>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14550/FILES/DERIVED_FILES/POS/Pos_QC1.mzXML</Mzxml><Mzxml>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14550/FILES/DERIVED_FILES/POS/Pos_QC3.mzXML</Mzxml><Mzxml>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14550/FILES/DERIVED_FILES/POS/Pos_MRS1.mzXML</Mzxml><Mzxml>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14550/FILES/DERIVED_FILES/NEG/Neg_QC1.mzXML</Mzxml><Mzxml>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14550/FILES/DERIVED_FILES/NEG/Neg_MRS3.mzXML</Mzxml><Mzxml>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14550/FILES/DERIVED_FILES/NEG/Neg_KD2.mzXML</Mzxml><Mzxml>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14550/FILES/DERIVED_FILES/NEG/Neg_MRS1.mzXML</Mzxml></files><type>primary</type></body><statusCodeValue>200</statusCodeValue><statusCode>OK</statusCode></file_versions><scores/><additional><ftp_download_link>ftp://ftp.ebi.ac.uk/pub/databases/metabolights/studies/public/MTBLS14550</ftp_download_link><metabolite_identification_protocol>&lt;p>The raw data were analyzed by MS-Dial version 5.3 against three databases, including MS-Dial ESI (+/-) MS/MS from authentic standards, Fiehn/Vaniya natural product, and BMDMS-NP.&lt;/p></metabolite_identification_protocol><repository>MetaboLights</repository><study_status>Public</study_status><ptm_modification></ptm_modification><instrument_platform>Liquid Chromatography MS - negative - reverse-phase</instrument_platform><instrument_platform>Liquid Chromatography MS - positive - reverse-phase</instrument_platform><chromatography_protocol>&lt;p>10 µl of sample was injected into a Poroshell 120 EC-C18 2.1 × 100 mm; 2.7 µm column (Agilent) kept at 50 °C, and separation was performed at 0.4 mL/min flow with 0.1% formic acid in water (A) and 0.1% formic acid in acetonitrile (B).&lt;/p></chromatography_protocol><publication>Metabolomic and Proteomic Profiling of the Antimicrobial Potentials from Lactobacillus johnsonii KD1 Cell-Free Supernatant against Foodborne Pathogenic Bacteria.</publication><submitter_affiliation>Mahidol University</submitter_affiliation><submitter_name>Kanokwan Dekham</submitter_name><organism_part>culture fluid</organism_part><organism_part>Growth Medium</organism_part><organism_part>Quality Control</organism_part><technology_type>mass spectrometry assay</technology_type><disease></disease><extraction_protocol>&lt;p class='ql-align-justify'>Three biological replicates of KD1 CFS (KD1-KD3) and the control MRS (MRS1-MRS3) were extracted with 100% methanol, containing 50 ng/ml sulfadimethoxine.&amp;nbsp;Then, the samples were centrifuged at 14,000 rpm for 10 min, and the supernatant was collected.&amp;nbsp;20 µl of each sample was taken for the pool QC sample.&amp;nbsp;Six dilutions of the undiluted pool QC sample (100%) were subsequently prepared at 80%, 50%, 20%, 10%, 1% and 0% in concentration.&amp;nbsp;The supernatant was subjected to an LC-MS (Agilent LC-QTOF 6545XT).&amp;nbsp;&lt;/p></extraction_protocol><organism>blank</organism><organism>Lactobacillus johnsonii</organism><organism>Quality Control</organism><full_dataset_link>https://www.ebi.ac.uk/metabolights/MTBLS14550</full_dataset_link><author>Kanokwan Dekham. Mahidol University. kanokwan.dek@gmail.com.</author><author>Soraya Chaturongakul. Mahidol University. soraya.cha@mahidol.ac.th.</author><data_transformation_protocol>&lt;p class='ql-align-justify'>Peak intensity was normalized with the LOWESS method with sulfadimethoxine (IS).&amp;nbsp;Data quality criteria included retention time limits at 0.2-18 min, coefficient of variation (%CV) among QC &amp;lt; 30%, and identification score ≥ 0.70.&amp;nbsp;Features that did not meet these criteria were excluded from further analysis.&lt;/p></data_transformation_protocol><study_factor>Group</study_factor><submitter_email>kanokwan.dek@gmail.com</submitter_email><sample_collection_protocol>&lt;p class='ql-align-justify'>The probiotic &lt;em>Lactobacillus johnsonii&lt;/em> KD1 was cultured in de Man Rogosa Sharpe (MRS) agar at 37 °C for 48 h. A single colony of the probiotic was inoculated in 50 ml of MRS broth and incubated at 37 °C for 24 h without shaking.&amp;nbsp;Then the bacterial culture was centrifuged at 5,000 rpm, at 4 °C for 10 min, and the supernatant was collected.&amp;nbsp;Supernatants were filtered through 0.22 membranes to remove bacterial cells, and the probiotic CFS was stored at 4 °C until use.&amp;nbsp;&amp;nbsp;&lt;/p>&lt;p>&lt;br>&lt;/p>&lt;p>&lt;br>&lt;/p></sample_collection_protocol><omics_type>Metabolomics</omics_type><study_design>pooled quality control sample</study_design><study_design>Metabolomics</study_design><study_design>blank</study_design><study_design>Cell-free supernatants</study_design><study_design>untargeted analysis</study_design><study_design>Untargeted metabolomic analysis</study_design><study_design>Growth Medium</study_design><study_design>6545XT Q-TOF LC/MS</study_design><study_design>Lactobacillus johnsonii KD1</study_design><study_design>experimental sample</study_design><study_design>culture fluid</study_design><study_design>Foodborne pathogens</study_design><study_design>Antibacterial activity</study_design><study_design>Lactobacillus johnsonii</study_design><study_design>Quality Control</study_design><curator_keywords>pooled quality control sample</curator_keywords><curator_keywords>Metabolomics</curator_keywords><curator_keywords>blank</curator_keywords><curator_keywords>Cell-free supernatants</curator_keywords><curator_keywords>untargeted analysis</curator_keywords><curator_keywords>Untargeted metabolomic analysis</curator_keywords><curator_keywords>Growth Medium</curator_keywords><curator_keywords>6545XT Q-TOF LC/MS</curator_keywords><curator_keywords>Lactobacillus johnsonii KD1</curator_keywords><curator_keywords>experimental sample</curator_keywords><curator_keywords>culture fluid</curator_keywords><curator_keywords>Foodborne pathogens</curator_keywords><curator_keywords>Antibacterial activity</curator_keywords><curator_keywords>Lactobacillus johnsonii</curator_keywords><curator_keywords>Quality Control</curator_keywords><mass_spectrometry_protocol>&lt;p class='ql-align-justify'>Mass spectrometry analysis was operated in high-resolution mode with electrospray ionization in both positive (pos) and negative (neg) polarities. The MS operating parameters were set as follows: drying gas temperature, 325 °C; drying gas flow, 13 L/h; sheath gas temperature, 275 °C; sheath gas flow, 12 L/h; nebulizer pressure, 45 psi; capillary voltage, 4000 V (pos) and 3000 V (neg); isotope width, 1.3 m/z; and scan mass ranges of 40-1700 m/z for MS1 and 25-1000 m/z for MS2. The collision energies were 20 eV for positive and 10 eV for negative modes. Data were acquired at a rate of 3.35 spectra/s, with a maximum of 10 precursors selected per cycle and a precursor threshold of 5000 counts. Continuous mass calibration was performed using reference masses at m/z 121.0509 and 922.0098 (positive mode), and m/z 112.9856 and 1033.9881 (negative mode) to ensure retention time threshold accuracy of 0.001%.&lt;/p></mass_spectrometry_protocol></additional><is_claimable>false</is_claimable><name>Metabolomic and Proteomic Profiling of the Antimicrobial Potentials from Lactobacillus johnsonii KD1 Cell-Free Supernatant against Foodborne Pathogenic Bacteria</name><description>&lt;p class='ql-align-justify'>This study characterized functions and metabolic profiles of cell-free supernatants (CFS) from &lt;em>Lactobacillus johnsonii&lt;/em> KD1 against three foodborne pathogens: the Gram-negative bacteria &lt;em>Vibrio parahaemolyticus&lt;/em> 3HP and &lt;em>Salmonella enterica&lt;/em> serovar Typhimurium LT2, and the Gram-positive bacterium &lt;em>Listeria monocytogenes&lt;/em> 10403S.&amp;nbsp;The minimum inhibitory concentration (MIC) at 25% CFS inhibited the growth of all tested pathogens. &amp;nbsp;At this concentration, the CFS exhibited bactericidal activity against both Gram-negative bacteria, while only bacteriostatic activity was observed against the Gram-positive bacterium.&amp;nbsp;Neutralized CFS demonstrated that antimicrobial activity was pH-dependent, as the MIC increased to 50% CFS for &lt;em>V. parahaemolyticus &lt;/em>and no inhibition was observed against &lt;em>S.&lt;/em> Typhimurium.&amp;nbsp;The stability of CFS at low temperature for 90 days has maintained antimicrobial activity with MIC from 12% to 25% against &lt;em>V. parahaemolyticus &lt;/em>with bactericidal effects.&amp;nbsp;Untargeted metabolomic profiling revealed numerous significant features, including 433 in positive ionization mode and 102 in negative mode. &amp;nbsp;Highly abundant metabolites in the positive mode were primarily classified as aminoglycosides, while the random forest analysis identified key discriminative metabolites from aminoglycosides, cardenolides and derivatives, and steroid esters. &amp;nbsp;In the negative mode, metabolites were mainly associated with probiotic metabolism, with 4-hydroxyphenyllactic acid identified as a potential biomarker contributing to inhibition of &lt;em>L. monocytogenes&lt;/em>. &amp;nbsp;Strong correlations were observed among key metabolites.&amp;nbsp;Proteomic analysis identified 24 proteins significantly secreted in the CFS from MRS media and the probiotic with glyceraldehyde-3-phosphate dehydrogenase, which served as a marker for &lt;em>L. johnsonii&lt;/em> KD1 CFS. &amp;nbsp;These findings suggest that the probiotic CFS can be used to combat foodborne bacteria and its application as a biopreservative in the food industry.&lt;/p></description><dates><publication>2026-09-24</publication><submission>2026-05-21</submission></dates><accession>MTBLS14550</accession><cross_references/></HashMap>