{
"METABOLOMICS WORKBENCH":{"STUDY_ID":"ST001118","ANALYSIS_ID":"AN001817","VERSION":"1","CREATED_ON":"December 26, 2018, 1:08 pm"},

"PROJECT":{"PROJECT_TITLE":"Untargeted GC-MS Analysis in human patients with Wilson disease","PROJECT_SUMMARY":"GC-MS analysis was used to analysis the metabolic profile of human patients with Wilson disease.","INSTITUTE":"University of California, Davis","LAST_NAME":"Fiehn","FIRST_NAME":"Oliver","ADDRESS":"451 East Health Science Drive","EMAIL":"ofiehn@ucdavis.edu","PHONE":"5307529922"},

"STUDY":{"STUDY_TITLE":"Metabolomics profiles of patients with Wilson disease reveal a distinct metabolic signature","STUDY_SUMMARY":"This study is comparing the plasma metabolomics profile of patients with the genetic disorder, Wilson disease, compared to healthy subjects matched by age, sex, and BMI. Wilson disease is caused by a defect in a copper transporter leading to copper accumulation in the liver and brain leading to liver and/or neuropsychiatric symptoms. Mitochondrial defects are well-documented in Wilson disease. We hypothesize the acylcarnitine and primary metabolite profile will differ between patients with Wilson disease and healthy subjects and that these differences may indicate specific metabolic abnormalities.","INSTITUTE":"University of California, Davis","LAST_NAME":"Medici","FIRST_NAME":"Valentina","ADDRESS":"4150 V St, Sacramento CA 95817","EMAIL":"vmedici@ucdavis.edu","PHONE":"N/A","NUM_GROUPS":"2","TOTAL_SUBJECTS":"110"},

"SUBJECT":{"SUBJECT_TYPE":"Human","SUBJECT_SPECIES":"Homo sapiens","TAXONOMY_ID":"9606"},
"SUBJECT_SAMPLE_FACTORS":[
{
"Subject ID":"-",
"Sample ID":"HC100_001",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"HC101_002",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"HC102_003",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"HC103_004",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"HC104_005",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"HC105_006",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"HC106_007",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"HC107_008",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"HC108_009",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"HC109_010",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"HC110_011",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"HC111_012",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"HC112_013",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"HC113_014",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"HC114_015",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"HC115_016",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"HC116_017",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"HC117_018",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"HC118_019",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"HC119_020",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"HC120_021",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"HC121_022",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"HC122_023",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"HC123_024",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"HC124_025",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"HC125_026",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"HC126_027",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"K1_033",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"K10_042",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"K2_034",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"K3_035",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"K4_036",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"K5_037",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"K6_038",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"K7_039",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"K8_040",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"K9_041",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"M1_028",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"M2_029",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"M3_030",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"M4_031",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"M5_032",
"Factors":{"Treatment Group":"Control"}
},
{
"Subject ID":"-",
"Sample ID":"1116_047",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1149_048",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1167_049",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1181_050",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1317_102",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1506_051",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1593_052",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1639_053",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1658_054",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1715_055",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1749_056",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1776_057",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1779_058",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1780_059",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1783_060",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1784_061",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1808_062",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1816_063",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1843_064",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1844_065",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1864_066",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1866_067",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1868_068",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1888_103",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1910_069",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1918_070",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1982_071",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1986_072",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"1998_073",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"2001_074",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"2024_075",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"205_043",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"2051_076",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"2055_077",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"2065_078",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"207_044",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"2086_079",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"2123_080",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"2124_081",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"2210_082",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"2243_083",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"2245_084",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"2251_085",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"2259_086",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"2275_087",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"2291_088",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"2301_089",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"2309_090",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"2354_091",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"2407_092",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"2415_093",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"2438_094",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"2452_095",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"2481_096",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"2486_097",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"2506_098",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"2508_099",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"2534_100",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"942_045",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"970_101",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"972_046",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"WD100_104",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"WD101_105",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"WD102_106",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"WD103_107",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"WD104_108",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"WD105_109",
"Factors":{"Treatment Group":"Wilson Disease"}
},
{
"Subject ID":"-",
"Sample ID":"WD106_110",
"Factors":{"Treatment Group":"Wilson Disease"}
}
],
"COLLECTION":{"COLLECTION_SUMMARY":"Plasma samples from patients with WD and healthy subjects were obtained from the Institute of Neurology and Psychiatry in Warsaw. Subjects fasted for 8 hours prior to sampling. Plasma samples were de-identified, shipped to the University of California, Davis and stored at -80°C until further analysis.","SAMPLE_TYPE":"Blood (plasma)","STORAGE_CONDITIONS":"-80℃"},

"TREATMENT":{"TREATMENT_SUMMARY":"NA"},

"SAMPLEPREP":{"SAMPLEPREP_SUMMARY":"All samples were removed from -80°C and allowed to thaw on ice. Of the 100-250 uL of plasma shipped to the facility for analysis, 30 µL of plasma was pipetted into a new 1.5 mL Eppendorf tube. 1 mL of 3:3:2 acetonitrile:isopropanol:water was added to each sample. Samples were vortexed for 10 seconds using a MiniVortexer. Samples were then shaken on an Orbital Mixing Chilling/Heating Plate for 5 minutes at 4°C. Samples were centrifuged for 2 minutes at 14,000 rcf used the centrifuge Eppendorf 5415 D. Two 475 µL aliquots were removed from the supernatant. Both samples were dried to complete using Labconco Centrivap cold trap. 500 µL of 50:50 acetonitrile was added to each aliquot of all samples. Samples were vortexed for 10 seconds using the MiniVortexer. Samples were centrifuged for 2 minutes at 14,000 rcf using the centrifuge Eppendorf 5415 D. 475 µL of supernatant was removed and evaporated to dryness using the Labconco Centrivap cold trap. One sample is submitted to derivitization, the other sample is saved for LC-MS analysis.","SAMPLE_DERIVATIZATION":"To the dried down samples, 10 µL of a prepared methoxyamine solution was added to each sample. Samples were shaken on an Orbital Mixing Chilling/Heating Plate at 30°C for 1.5 hours. 91 µL of a N-methyl-N-(trimethylsilyl)-trifluoroacetamide (MSTFA) and fatty-acid methyl-esters (FAMES) solution was added to each sample. Samples were shaken on an Orbital Mixing Chilling/Heating Plate at 37°C for 30 minutes. Contents were transferred to individual glass vials with micro-inserts and capped immediately. Submitted to GC-MS analysis."},

"CHROMATOGRAPHY":{"CHROMATOGRAPHY_TYPE":"GC","INSTRUMENT_NAME":"Agilent 6890N","COLUMN_NAME":"Restek Rtx-5Sil MS (30 x 0.25mm, 0.25um)"},

"ANALYSIS":{"ANALYSIS_TYPE":"MS"},

"MS":{"MS_COMMENTS":"-","INSTRUMENT_NAME":"Leco Pegasus III GC TOF","INSTRUMENT_TYPE":"GC-TOF","MS_TYPE":"EI","ION_MODE":"POSITIVE"},

"MS_METABOLITE_DATA":{
"Units":"Peak Height",

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}

}