{
"METABOLOMICS WORKBENCH":{"STUDY_ID":"ST000161","ANALYSIS_ID":"AN000253","VERSION":"1","CREATED_ON":"2016-09-17"},

"PROJECT":{"PROJECT_TITLE":"Human AxP","PROJECT_SUMMARY":"Plasma Nucleotide/adenosine concentrations","INSTITUTE":"University of Michigan","DEPARTMENT":"Internal Medicine-Cardiology","LABORATORY":"Visovatti Lab","LAST_NAME":"Visovatti","FIRST_NAME":"Scott","ADDRESS":"Ann Arbor, MI","EMAIL":"shv@med.umich.edu","PHONE":"734-657-6917"},

"STUDY":{"STUDY_TITLE":"Plasma Nucleotide/adenosine concentrations (Human AxP Batch 3)","STUDY_TYPE":"Exercise and rest","STUDY_SUMMARY":"This experiment was performed using the following cohorts: 1) healthy controls, patients with scleroderma at low risk for pulmonary hypertension, 3) pateints scleroderma at high risk for pulmonary hypertension. Whole blood was drawn into stop soilution (1:1 ratio) at rest and again at peak exercise for each subject.","INSTITUTE":"University of Michigan","DEPARTMENT":"Biomedical Research Core Facilities","LABORATORY":"Metabolomics core","LAST_NAME":"Kachman","FIRST_NAME":"Maureen","ADDRESS":"6300 Brehm Tower, 1000 Wall Street, Ann Arbor, MI 48105-5714","EMAIL":"mkachman@umich.edu","PHONE":"-","NUM_GROUPS":"4","TOTAL_SUBJECTS":"24"},

"SUBJECT":{"SUBJECT_TYPE":"-","SUBJECT_SPECIES":"Homo sapiens","TAXONOMY_ID":"9606"},
"SUBJECT_SAMPLE_FACTORS":[
{
"Subject ID":"SU0005218",
"Sample ID":"S00016692",
"Factors":{"Exercise":"no","Group":"Healthy"}
},
{
"Subject ID":"SU0005219",
"Sample ID":"S00016694",
"Factors":{"Exercise":"no","Group":"Healthy"}
},
{
"Subject ID":"SU0005220",
"Sample ID":"S00016696",
"Factors":{"Exercise":"no","Group":"Healthy"}
},
{
"Subject ID":"SU0005226",
"Sample ID":"S00016708",
"Factors":{"Exercise":"no","Group":"Healthy"}
},
{
"Subject ID":"SU0005216",
"Sample ID":"S00016688",
"Factors":{"Exercise":"no","Group":"SSc-high"}
},
{
"Subject ID":"SU0005217",
"Sample ID":"S00016690",
"Factors":{"Exercise":"no","Group":"SSc-high"}
},
{
"Subject ID":"SU0005221",
"Sample ID":"S00016698",
"Factors":{"Exercise":"no","Group":"SSc-high"}
},
{
"Subject ID":"SU0005222",
"Sample ID":"S00016700",
"Factors":{"Exercise":"no","Group":"SSc-high"}
},
{
"Subject ID":"SU0005223",
"Sample ID":"S00016702",
"Factors":{"Exercise":"no","Group":"SSc-high"}
},
{
"Subject ID":"SU0005224",
"Sample ID":"S00016704",
"Factors":{"Exercise":"no","Group":"SSc-high"}
},
{
"Subject ID":"SU0005225",
"Sample ID":"S00016706",
"Factors":{"Exercise":"no","Group":"SSc-high"}
},
{
"Subject ID":"SU0005227",
"Sample ID":"S00016710",
"Factors":{"Exercise":"no","Group":"SSc-high"}
},
{
"Subject ID":"SU0005218",
"Sample ID":"S00016693",
"Factors":{"Exercise":"yes","Group":"Healthy"}
},
{
"Subject ID":"SU0005219",
"Sample ID":"S00016695",
"Factors":{"Exercise":"yes","Group":"Healthy"}
},
{
"Subject ID":"SU0005220",
"Sample ID":"S00016697",
"Factors":{"Exercise":"yes","Group":"Healthy"}
},
{
"Subject ID":"SU0005226",
"Sample ID":"S00016709",
"Factors":{"Exercise":"yes","Group":"Healthy"}
},
{
"Subject ID":"SU0005216",
"Sample ID":"S00016689",
"Factors":{"Exercise":"yes","Group":"SSc-high"}
},
{
"Subject ID":"SU0005217",
"Sample ID":"S00016691",
"Factors":{"Exercise":"yes","Group":"SSc-high"}
},
{
"Subject ID":"SU0005221",
"Sample ID":"S00016699",
"Factors":{"Exercise":"yes","Group":"SSc-high"}
},
{
"Subject ID":"SU0005222",
"Sample ID":"S00016701",
"Factors":{"Exercise":"yes","Group":"SSc-high"}
},
{
"Subject ID":"SU0005223",
"Sample ID":"S00016703",
"Factors":{"Exercise":"yes","Group":"SSc-high"}
},
{
"Subject ID":"SU0005224",
"Sample ID":"S00016705",
"Factors":{"Exercise":"yes","Group":"SSc-high"}
},
{
"Subject ID":"SU0005225",
"Sample ID":"S00016707",
"Factors":{"Exercise":"yes","Group":"SSc-high"}
},
{
"Subject ID":"SU0005227",
"Sample ID":"S00016711",
"Factors":{"Exercise":"yes","Group":"SSc-high"}
}
],
"COLLECTION":{"COLLECTION_SUMMARY":"-","SAMPLE_TYPE":"Plasma"},

"TREATMENT":{"TREATMENT_SUMMARY":"-"},

"SAMPLEPREP":{"SAMPLEPREP_SUMMARY":"-","SAMPLEPREP_PROTOCOL_FILENAME":"Gly-TCA-nucleotides_analysis_protocol-2015-03-09.docx"},

"CHROMATOGRAPHY":{"CHROMATOGRAPHY_TYPE":"HILIC","INSTRUMENT_NAME":"Agilent 1260","COLUMN_NAME":"Phenomenex Luna NH2 (150 x 1mm, 3um)","METHODS_ID":"AQM015","METHODS_FILENAME":"QQQ-ATP,ADP,AMP,A-Insert.m"},

"ANALYSIS":{"ANALYSIS_TYPE":"MS","LABORATORY_NAME":"MRC2 (University of Michigan)","ACQUISITION_PARAMETERS_FILE":"QQQ-ATP,ADP,AMP,A-Insert.m","PROCESSING_PARAMETERS_FILE":"EX00370-Nucleotides-Quant.m"},

"MS":{"MS_COMMENTS":"-","INSTRUMENT_NAME":"Agilent 6520 QTOF","INSTRUMENT_TYPE":"QTOF","MS_TYPE":"ESI","ION_MODE":"NEGATIVE"},

"MS_METABOLITE_DATA":{
"Units":"nM",

"Data":[{"Metabolite":"Adenosine","S00016692":"56.9800","S00016694":"67.6400","S00016696":"68.3000","S00016708":"92.8300","S00016688":"41.9600","S00016690":"64.9300","S00016698":"43.7700","S00016700":"67.1300","S00016702":"64.0900","S00016704":"58.3700","S00016706":"59.5100","S00016710":"37.3600","S00016693":"44.6500","S00016695":"66.5800","S00016697":"45.2200","S00016709":"65.2900","S00016689":"38.9800","S00016691":"55.8500","S00016699":"71.7900","S00016701":"68.2400","S00016703":"64.9500","S00016705":"61.2600","S00016707":"53.0800","S00016711":"45.1000"},{"Metabolite":"ADP","S00016692":"264.6300","S00016694":"446.7300","S00016696":"278.9000","S00016708":"239.3300","S00016688":"151.7000","S00016690":"454.6900","S00016698":"395.2700","S00016700":"347.7900","S00016702":"430.7200","S00016704":"245.4900","S00016706":"252.1300","S00016710":"148.2200","S00016693":"193.5200","S00016695":"209.7800","S00016697":"188.0800","S00016709":"152.0500","S00016689":"204.6400","S00016691":"296.3400","S00016699":"401.8600","S00016701":"692.2700","S00016703":"366.9900","S00016705":"191.7800","S00016707":"379.8500","S00016711":"331.2000"},{"Metabolite":"AMP","S00016692":"162.6100","S00016694":"101.7200","S00016696":"179.6100","S00016708":"185.0800","S00016688":"147.2800","S00016690":"101.9500","S00016698":"145.5300","S00016700":"186.8400","S00016702":"134.6900","S00016704":"117.1200","S00016706":"143.2100","S00016710":"183.5800","S00016693":"187.4400","S00016695":"137.1300","S00016697":"122.9200","S00016709":"178.7200","S00016689":"182.0000","S00016691":"149.0100","S00016699":"153.8300","S00016701":"128.2500","S00016703":"71.5200","S00016705":"147.3400","S00016707":"85.3500","S00016711":"106.4300"},{"Metabolite":"ATP","S00016692":"699.2700","S00016694":"1064.7800","S00016696":"870.2400","S00016708":"868.2300","S00016688":"413.9500","S00016690":"1182.1200","S00016698":"1397.4600","S00016700":"1090.8700","S00016702":"909.6400","S00016704":"722.1100","S00016706":"587.5200","S00016710":"516.7900","S00016693":"530.1000","S00016695":"579.3500","S00016697":"514.4100","S00016709":"441.9800","S00016689":"602.7700","S00016691":"778.6200","S00016699":"1418.4600","S00016701":"1618.4500","S00016703":"591.2600","S00016705":"490.6500","S00016707":"1037.9800","S00016711":"454.5600"}],

"Metabolites":[{"Metabolite":"Adenosine","moverz_quant":"","ri":"","ri_type":"","pubchem_id":"60961","inchi_key":"","kegg_id":"","other_id":"Adenosine","other_id_type":"UM_Target_ID"},{"Metabolite":"ADP","moverz_quant":"","ri":"","ri_type":"","pubchem_id":"6022","inchi_key":"","kegg_id":"","other_id":"ADP","other_id_type":"UM_Target_ID"},{"Metabolite":"AMP","moverz_quant":"","ri":"","ri_type":"","pubchem_id":"6083","inchi_key":"","kegg_id":"","other_id":"AMP","other_id_type":"UM_Target_ID"},{"Metabolite":"ATP","moverz_quant":"","ri":"","ri_type":"","pubchem_id":"5957","inchi_key":"","kegg_id":"","other_id":"ATP","other_id_type":"UM_Target_ID"}]
}

}