#METABOLOMICS WORKBENCH araskind_20150413_9944401_mwtab.txt DATATRACK_ID:230 STUDY_ID:ST000155 ANALYSIS_ID:AN000247 PROJECT_ID:PR000134
VERSION             	1
CREATED_ON          	2016-09-17
#PROJECT
PR:PROJECT_TITLE                 	Fly Brain Studies
PR:PROJECT_SUMMARY               	Measure change in metabolites according to diet and feeding state
PR:INSTITUTE                     	University of Michigan
PR:DEPARTMENT                    	MCDB LS&A
PR:LABORATORY                    	Dus Lab
PR:LAST_NAME                     	Dus
PR:FIRST_NAME                    	Monica
PR:ADDRESS                       	Ann Arbor, MI
PR:EMAIL                         	mdus@umich.edu
PR:PHONE                         	347-891-2287
#STUDY
ST:STUDY_TITLE                   	ND/HSD sated/fasted fly brains
ST:STUDY_TYPE                    	diet over time
ST:STUDY_SUMMARY                 	Flies were fed a normal diet or high-sugar (30% sucrose) diet for 7 days.
ST:STUDY_SUMMARY                 	of flies fasted for 24h or sated were microdissected and immediately frozen in
ST:STUDY_SUMMARY                 	ice. The microdissection process from taking the fly out of the vial to
ST:STUDY_SUMMARY                 	the brain took less than a minute. Each brain microdissected piece contains
ST:STUDY_SUMMARY                 	50K cells.We dissected 40 brains per condition (4 conditions total) and 4-5
ST:STUDY_SUMMARY                 	replicates
ST:INSTITUTE                     	University of Michigan
ST:DEPARTMENT                    	Biomedical Research Core Facilities
ST:LABORATORY                    	Metabolomics core
ST:LAST_NAME                     	Kachman
ST:FIRST_NAME                    	Maureen
ST:ADDRESS                       	6300 Brehm Tower, 1000 Wall Street, Ann Arbor, MI 48105-5714
ST:EMAIL                         	mkachman@umich.edu
ST:PHONE                         	-
ST:NUM_GROUPS                    	4
ST:TOTAL_SUBJECTS                	20
#SUBJECT
SU:SUBJECT_TYPE                  	-
SU:SUBJECT_SPECIES               	Drosophila melanogaster
SU:TAXONOMY_ID                   	7227
#SUBJECT_SAMPLE_FACTORS:         	SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data
SUBJECT_SAMPLE_FACTORS           	SU0011580	S00017073	Condition:fasted | Diet:control	
SUBJECT_SAMPLE_FACTORS           	SU0011580	S00017074	Condition:fasted | Diet:control	
SUBJECT_SAMPLE_FACTORS           	SU0011580	S00017075	Condition:fasted | Diet:control	
SUBJECT_SAMPLE_FACTORS           	SU0011580	S00017076	Condition:fasted | Diet:control	
SUBJECT_SAMPLE_FACTORS           	SU0011580	S00017077	Condition:fasted | Diet:control	
SUBJECT_SAMPLE_FACTORS           	SU0011582	S00017083	Condition:fasted | Diet:high sugar	
SUBJECT_SAMPLE_FACTORS           	SU0011582	S00017084	Condition:fasted | Diet:high sugar	
SUBJECT_SAMPLE_FACTORS           	SU0011582	S00017085	Condition:fasted | Diet:high sugar	
SUBJECT_SAMPLE_FACTORS           	SU0011582	S00017086	Condition:fasted | Diet:high sugar	
SUBJECT_SAMPLE_FACTORS           	SU0011582	S00017087	Condition:fasted | Diet:high sugar	
SUBJECT_SAMPLE_FACTORS           	SU0011579	S00017068	Condition:sated | Diet:control	
SUBJECT_SAMPLE_FACTORS           	SU0011579	S00017069	Condition:sated | Diet:control	
SUBJECT_SAMPLE_FACTORS           	SU0011579	S00017070	Condition:sated | Diet:control	
SUBJECT_SAMPLE_FACTORS           	SU0011579	S00017071	Condition:sated | Diet:control	
SUBJECT_SAMPLE_FACTORS           	SU0011579	S00017072	Condition:sated | Diet:control	
SUBJECT_SAMPLE_FACTORS           	SU0011581	S00017078	Condition:sated | Diet:high sugar	
SUBJECT_SAMPLE_FACTORS           	SU0011581	S00017079	Condition:sated | Diet:high sugar	
SUBJECT_SAMPLE_FACTORS           	SU0011581	S00017080	Condition:sated | Diet:high sugar	
SUBJECT_SAMPLE_FACTORS           	SU0011581	S00017081	Condition:sated | Diet:high sugar	
SUBJECT_SAMPLE_FACTORS           	SU0011581	S00017082	Condition:sated | Diet:high sugar	
#COLLECTION
CO:COLLECTION_SUMMARY            	-
CO:SAMPLE_TYPE                   	Tissues
#TREATMENT
TR:TREATMENT_SUMMARY             	-
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	-
SP:SAMPLEPREP_PROTOCOL_FILENAME  	Gly-TCA-nucleotides_analysis_protocol-2015-03-09.docx
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_TYPE           	HILIC
CH:INSTRUMENT_NAME               	Agilent 1260
CH:COLUMN_NAME                   	Phenomenex Luna NH2 (150 x 1mm, 3um)
CH:METHODS_ID                    	AQM020
CH:METHODS_FILENAME              	QTOF-002-HILIC-35min-1mm.m
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
AN:LABORATORY_NAME               	MRC2 (University of Michigan)
AN:ACQUISITION_PARAMETERS_FILE   	QTOF-002-HILIC-35min-1mm.m
AN:PROCESSING_PARAMETERS_FILE    	2015210-EX00393-QTOF6520-Dus-GlyTCA-MK-batch.m
#MS
MS:MS_COMMENTS                   	-
MS:INSTRUMENT_NAME               	Agilent 6520 QTOF
MS:INSTRUMENT_TYPE               	QTOF
MS:MS_TYPE                       	ESI
MS:ION_MODE                      	NEGATIVE
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS         	pmol/µg protein
MS_METABOLITE_DATA_START
Samples	S00017073	S00017074	S00017075	S00017076	S00017077	S00017083	S00017084	S00017085	S00017086	S00017087	S00017068	S00017069	S00017070	S00017071	S00017072	S00017078	S00017079	S00017080	S00017081	S00017082
Factors	Condition:fasted | Diet:control	Condition:fasted | Diet:control	Condition:fasted | Diet:control	Condition:fasted | Diet:control	Condition:fasted | Diet:control	Condition:fasted | Diet:high sugar	Condition:fasted | Diet:high sugar	Condition:fasted | Diet:high sugar	Condition:fasted | Diet:high sugar	Condition:fasted | Diet:high sugar	Condition:sated | Diet:control	Condition:sated | Diet:control	Condition:sated | Diet:control	Condition:sated | Diet:control	Condition:sated | Diet:control	Condition:sated | Diet:high sugar	Condition:sated | Diet:high sugar	Condition:sated | Diet:high sugar	Condition:sated | Diet:high sugar	Condition:sated | Diet:high sugar
2 or 3-phosphoglycerate_2PG/3PG	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000
6-Phosphogluconate	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000
Acetyl-CoA	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000
Adenosine diphosphate	5.0806	3.0466	3.2344	5.9242	1.5673	6.8244	3.1703	3.8846	10.7380	3.9105	3.3186	2.4265	5.8054	2.4669	6.4977	4.0107	3.8133	7.7408	2.2904	5.4255
Adenosine monophosphate	41.1770	24.9350	28.0520	41.7640	21.4380	70.3530	39.0180	54.0670	98.2640	37.3530	25.9550	34.0680	16.8940	47.1520	16.3920	29.7770	36.8250	24.6610	24.3630	42.0280
Adenosine triphosphate	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000
Citrate or Isocitrate	7.1071	2.7974	6.5738	6.2296	2.7519	12.9780	3.9084	8.9971	11.6190	4.1513	3.6030	13.1190	4.4001	9.0704	6.2473	6.2786	5.5425	5.6262	6.2966	4.9405
Erythrose 4-phosphate	11.1510	3.2470	12.5400	10.6100	3.5976	13.2940	5.6059	15.8130	15.2360	7.5040	7.4941	0.9998	6.9028	4.3878	9.4113	16.6880	9.7074	11.0330	12.4360	9.0901
Fructose 1_6-bisphosphate	9.4152	3.4024	4.5013	11.5510	3.0638	9.2575	3.8802	3.9708	20.0080	9.5633	3.4780	2.3677	5.6536	2.9929	5.1355	5.0315	6.0070	9.0934	2.8150	6.2375
Malate	10.6840	5.0742	18.1420	4.9983	2.7833	14.5960	6.4834	10.8760	10.3660	3.2594	4.7340	149.2200	9.2776	88.7480	22.5070	30.1520	18.9140	20.9240	13.7310	7.5024
Nicotinamide Adenine Dinucleotide oxidized	4.8160	3.0503	3.5260	4.9278	2.3338	7.2833	3.5563	6.1228	10.4510	3.7124	3.4071	5.8263	2.7689	6.8542	3.0169	3.2886	3.8117	3.3415	3.7367	5.4384
Nicotinamide Adenine Dinucleotide reduced	96.6030	24.3220	36.2930	62.4460	20.8990	77.2650	65.1510	17.0110	133.0800	52.2070	71.0010	45.6540	17.0350	42.4230	26.0840	38.4330	138.7200	27.9390	49.9570	109.9200
Phosphoenolpyruvate	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000
Ribose-5-phosphate or xylulose 5-phosphate	3.8868	1.9624	2.4208	3.4875	1.7177	5.8023	3.3326	3.8324	8.3775	2.2465	2.8238	2.3784	1.5533	3.5875	1.5019	2.5502	3.9366	2.1012	2.0970	4.8500
Sedoheptulose 7-phosphate	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000
Sucrose	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000	0.0000
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
2 or 3-phosphoglycerate_2PG/3PG				724			2PG/3PG	UM_Target_ID
6-Phosphogluconate				91493			6PG	UM_Target_ID
Acetyl-CoA				444493			aCoA	UM_Target_ID
Adenosine diphosphate				6022			ADP	UM_Target_ID
Adenosine monophosphate				6083			AMP	UM_Target_ID
Adenosine triphosphate				5957			ATP	UM_Target_ID
Citrate or Isocitrate				311			CIT/ICIT	UM_Target_ID
Erythrose 4-phosphate				122357			E4P	UM_Target_ID
Fructose 1,6-bisphosphate				21125049			FBP	UM_Target_ID
Malate				525			MAL	UM_Target_ID
Nicotinamide Adenine Dinucleotide oxidized				15938971			NAD	UM_Target_ID
Nicotinamide Adenine Dinucleotide reduced				439153			NADH	UM_Target_ID
Phosphoenolpyruvate				1005			PEP	UM_Target_ID
Ribose-5-phosphate or xylulose 5-phosphate				77982			R5P/X5P	UM_Target_ID
Sedoheptulose 7-phosphate				165007			S7P	UM_Target_ID
Sucrose				5988			SUC	UM_Target_ID
METABOLITES_END
#END