#METABOLOMICS WORKBENCH amitch_20150922_9378651_mwtab.txt DATATRACK_ID:383 STUDY_ID:ST000249 ANALYSIS_ID:AN000393 PROJECT_ID:PR000201
VERSION             	1
CREATED_ON          	2016-09-17
#PROJECT
PR:PROJECT_TITLE                 	Myc-directed suppression of autophagy provides therapeutic vulnerabilities
PR:PROJECT_TITLE                 	amino acid homeostasis
PR:PROJECT_TYPE                  	Targeted LCMS Metabolomics
PR:PROJECT_SUMMARY               	Hypothesis:MYC is suppressing the autophagy pathway which leads to impaired
PR:PROJECT_SUMMARY               	of proteins and reduced free AA in the cells.
PR:INSTITUTE                     	Moffitt Cancer Center
PR:DEPARTMENT                    	Tumor Biology
PR:LABORATORY                    	John Cleveland
PR:LAST_NAME                     	Cleveland
PR:FIRST_NAME                    	John
PR:ADDRESS                       	12902 Magnolia Dr
PR:EMAIL                         	Tampa, FL 33612
PR:PHONE                         	813 745 3888
PR:FUNDING_SOURCE                	NIH
#STUDY
ST:STUDY_TITLE                   	Measurement of free amino acid (AA) in response to MYC
ST:STUDY_TYPE                    	treatment
ST:STUDY_SUMMARY                 	The proposed study will provide us information how the different AAs are
ST:STUDY_SUMMARY                 	by MYC. MYC is known to cause increased levels of glutamin due to import and
ST:STUDY_SUMMARY                 	but we hypothesize that the overall pool of free AA in the cells is reduced,
ST:STUDY_SUMMARY                 	when cells are starved.
ST:INSTITUTE                     	University of Florida
ST:DEPARTMENT                    	SECIM
ST:LAST_NAME                     	Schaub
ST:FIRST_NAME                    	Franz
ST:ADDRESS                       	-
ST:EMAIL                         	Franz.Schaub@moffitt.org
ST:PHONE                         	-
ST:NUM_GROUPS                    	2
ST:TOTAL_SUBJECTS                	6
#SUBJECT
SU:SUBJECT_TYPE                  	Human
SU:SUBJECT_SPECIES               	Homo sapiens
SU:TAXONOMY_ID                   	9606
SU:SPECIES_GROUP                 	Human
#SUBJECT_SAMPLE_FACTORS:         	SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data
SUBJECT_SAMPLE_FACTORS           	-	48hr_TET_1	Treatment:48 hour Tet treatment	sample type=Cell pellet from P493-6 B Cells
SUBJECT_SAMPLE_FACTORS           	-	48hr_TET_2	Treatment:48 hour Tet treatment	sample type=Cell pellet from P493-6 B Cells
SUBJECT_SAMPLE_FACTORS           	-	48hr_TET_3	Treatment:48 hour Tet treatment	sample type=Cell pellet from P493-6 B Cells
SUBJECT_SAMPLE_FACTORS           	-	48hr_NoTET_1	Treatment:No Tet treatment	sample type=Cell pellet from P493-6 B Cells
SUBJECT_SAMPLE_FACTORS           	-	48hr_NoTET_2	Treatment:No Tet treatment	sample type=Cell pellet from P493-6 B Cells
SUBJECT_SAMPLE_FACTORS           	-	48hr_NoTET_3	Treatment:No Tet treatment	sample type=Cell pellet from P493-6 B Cells
#COLLECTION
CO:COLLECTION_SUMMARY            	Cells were counted, washed with cold PBS and then flash-frozen in liquid N2
CO:SAMPLE_TYPE                   	Cells
CO:VOLUMEORAMOUNT_COLLECTED      	1.00E7
#TREATMENT
TR:TREATMENT_SUMMARY             	Cells were treated with TET for 48 hrs (TET samples) and then washed and
TR:TREATMENT_SUMMARY             	without TET for 48hrs (noTET samples)
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	Amino acid
SP:SAMPLEPREP_PROTOCOL_FILENAME  	SB_AA_Assay.pdf
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_SUMMARY        	Amino Acid
CH:CHROMATOGRAPHY_TYPE           	Reversed phase
MS:INSTRUMENT_NAME               	Agilent 6490 QQQ
CH:COLUMN_NAME                   	Waters AccQ Tag (100 x 2mm, 1.7um)
CH:METHODS_FILENAME              	SB_AA_Assay.pdf
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
AN:LABORATORY_NAME               	Sanford Burnham
AN:DETECTOR_TYPE                 	Triple Quadrupole
#MS
MS:INSTRUMENT_NAME               	Agilent 6490 QQQ
MS:INSTRUMENT_TYPE               	Triple quadrupole
MS:MS_TYPE                       	ESI
MS:ION_MODE                      	POSITIVE
MS:MS_COMMENTS                   	Amino Acids
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS         	nmol/million cells
MS_METABOLITE_DATA_START
Samples	48hr_TET_1	48hr_TET_2	48hr_TET_3	48hr_NoTET_1	48hr_NoTET_2	48hr_NoTET_3
Factors	Treatment:48 hour Tet treatment	Treatment:48 hour Tet treatment	Treatment:48 hour Tet treatment	Treatment:No Tet treatment	Treatment:No Tet treatment	Treatment:No Tet treatment
Alanine	0.3090	0.2532	0.3071	0.3312	0.4396	0.4614
Arginine	0.1119	0.0880	0.0752	0.1316	0.1519	0.1505
Asparagine	0.3839	0.3703	0.3897	0.6176	0.7081	0.7002
Aspartic Acid	1.8494	1.6285	1.6821	1.3932	1.7418	1.6675
Citrulline						
Glutamic Acid	9.7901	8.9728	9.5972	9.8469	11.9768	10.2894
Glutamine	2.3819	2.0457	2.1411	2.5200	3.3155	3.4919
Glycine	1.4412	1.2484	1.1886	0.7270	1.0621	0.9695
Histidine	0.0695	0.0579	0.0615	0.0496	0.0784	0.0662
Isoleucine	0.1405	0.1207	0.1479	0.1329	0.1471	0.1665
Leucine	0.1531	0.1285	0.1525	0.1254	0.1441	0.1486
Lysine						
Methionine	0.0790	0.0780	0.0770	0.0695	0.0801	0.0772
Ornithine						
Phenylalanine	0.0557	0.0480	0.0552	0.0466	0.0598	0.0532
Proline	0.4964	0.4306	0.4714	1.0962	1.3621	1.4309
Serine	0.1952	0.1563	0.1813	0.1547	0.2017	0.2162
Threonine	0.1525	0.1243	0.1413	0.1462	0.2107	0.1861
Tryptophan	0.0120	0.0098	0.0129	0.0092	0.0127	0.0124
Tyrosine	0.0672	0.0652	0.0697	0.0670	0.0753	0.0756
Valine	0.0840	0.0796	0.0787	0.0536	0.0692	0.0650
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name	moverz_quant	ri	ri_type	pubchem_id	inchi_key	kegg_id	other_id	other_id_type
Alanine	260.17, 171	4.16	UFLORIDA_MS_RI	5950		C00041		UFLORIDA_FEATURE
Arginine	345.21, 170.9	2.68	UFLORIDA_MS_RI	6322		C00062		UFLORIDA_FEATURE
Asparagine	303.13, 170.9	2.25	UFLORIDA_MS_RI	6267		C00152		UFLORIDA_FEATURE
Aspartic Acid	304.11, 171	2.99	UFLORIDA_MS_RI	5960		C00049		UFLORIDA_FEATURE
Citrulline	346.21, 171	3.33	UFLORIDA_MS_RI	9750		C00327		UFLORIDA_FEATURE
Glutamic Acid	318.11, 171.1	3.35	UFLORIDA_MS_RI	33032				UFLORIDA_FEATURE
Glutamine	317.21, 171	2.65	UFLORIDA_MS_RI	5961		C00064		UFLORIDA_FEATURE
Glycine	246.08, 170.9	2.81	UFLORIDA_MS_RI	750		C00037		UFLORIDA_FEATURE
Histidine	326.21, 110	2.07	UFLORIDA_MS_RI	6274		C00135		UFLORIDA_FEATURE
Isoleucine	302.21, 170.9	8.15	UFLORIDA_MS_RI	6306		C00407		UFLORIDA_FEATURE
Leucine	302.21, 170.9	8.26	UFLORIDA_MS_RI	6106		C00123		UFLORIDA_FEATURE
Lysine	487.21, 170.9	6.66	UFLORIDA_MS_RI	5962		C00047		UFLORIDA_FEATURE
Methionine	320.21, 170.9	6.87	UFLORIDA_MS_RI	6137		C00073		UFLORIDA_FEATURE
Ornithine	473.22, 170.9	5.93	UFLORIDA_MS_RI	6262		C00077		UFLORIDA_FEATURE
Phenylalanine	336.21, 170.9	8.40	UFLORIDA_MS_RI	6140		C00079		UFLORIDA_FEATURE
Proline	286.16, 171	4.84	UFLORIDA_MS_RI	145742		C00148		UFLORIDA_FEATURE
Serine	276.11, 170.9	2.60	UFLORIDA_MS_RI	5951		C00065		UFLORIDA_FEATURE
Threonine	290.11, 170.9	3.74	UFLORIDA_MS_RI	6288		C00188		UFLORIDA_FEATURE
Tryptophan	375.21, 171	8.54	UFLORIDA_MS_RI	6305		C00078		UFLORIDA_FEATURE
Tyrosine	352.21, 170.9	6.66	UFLORIDA_MS_RI	6057		C00082		UFLORIDA_FEATURE
Valine	288.21, 171	7.09	UFLORIDA_MS_RI	6287		C00183		UFLORIDA_FEATURE
METABOLITES_END
#END