#METABOLOMICS WORKBENCH araskind_20150607_9912061_mwtab.txt DATATRACK_ID:283 STUDY_ID:ST000279 ANALYSIS_ID:AN000445 PROJECT_ID:PR000222
VERSION             	1
CREATED_ON          	01-15-2019
#PROJECT
PR:PROJECT_TITLE                 	Viral Effect on Metabolism
PR:PROJECT_TYPE                  	Glycolysis/TCA/Nucleotide analysis (tissue/cells)
PR:PROJECT_SUMMARY               	Global Metabolic profiling of infection by respiratory virus
PR:INSTITUTE                     	University of Texas Medical Branch
PR:DEPARTMENT                    	Department of Pediatrics
PR:LABORATORY                    	Casola Lab
PR:LAST_NAME                     	Casola
PR:FIRST_NAME                    	Antonella
PR:ADDRESS                       	Galveston, TX
PR:EMAIL                         	yazhao1@utmb.edu
PR:PHONE                         	409-772-2798
PR:DOI                           	http://dx.doi.org/10.21228/M8TP4R
#STUDY
ST:STUDY_TITLE                   	Viral Effect on Metabolism (part II)
ST:STUDY_TYPE                    	Glycolysis/TCA/Nucleotide analysis (tissue/cells)
ST:STUDY_SUMMARY                 	Small airway epithelial cell (SAEC) (Lonza Walkersville, Inc., MD) were grown
ST:STUDY_SUMMARY                 	according to the manufacturer's instructions in growth medium (SAGM) containing
ST:STUDY_SUMMARY                 	0.03 mg/ml bovine pituitary extract (BPE), 0.5 µg/ml hydrocortisone, 0.5 ng/ml
ST:STUDY_SUMMARY                 	hEGF, 0.5 µg/ml epinephrine, 10 µg/ml transferrin, 5 µg/ml insulin, 0.1 ng/ml
ST:STUDY_SUMMARY                 	retinoic acid, 6.5ng/ml triiodothyronine, 50 µg/ml gentamicin and 50ng/ml
ST:STUDY_SUMMARY                 	Amphotericin-B, and 0.5 mg/ml bovine serum albumin (BSA, fatty acid free). When
ST:STUDY_SUMMARY                 	SAE grew to around 80 to 90% confluence, the cells were put into basal medium
ST:STUDY_SUMMARY                 	not supplemented with growth factors 3hours. Then the cell monolayers were
ST:STUDY_SUMMARY                 	infected with naïve hMPV at multiplicity of infection (MOI) of 3 to certain
ST:STUDY_SUMMARY                 	time. The supernatant was saved and cells were harvested and stored exactly
ST:STUDY_SUMMARY                 	according to the protocol provided by University of Michigan Metabolomics Core
ST:STUDY_SUMMARY                 	Facility for metabolomics analysis. 50mM ammonium acetate in water was used for
ST:STUDY_SUMMARY                 	rinse buffer.
ST:INSTITUTE                     	University of Michigan
ST:DEPARTMENT                    	Department of Pediatrics
ST:LABORATORY                    	Casola Lab (University of Texas Medical Branch)
ST:LAST_NAME                     	Zhao
ST:FIRST_NAME                    	Yanhua
ST:ADDRESS                       	Galveston, TX
ST:EMAIL                         	yazhao1@utmb.edu
ST:PHONE                         	409-443-1461
#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           	-	S00017199	Time:Naïve hMPV | Diseased:0hr	
SUBJECT_SAMPLE_FACTORS           	-	S00017200	Time:Naïve hMPV | Diseased:0hr	
SUBJECT_SAMPLE_FACTORS           	-	S00017201	Time:Naïve hMPV | Diseased:0hr	
SUBJECT_SAMPLE_FACTORS           	-	S00017205	Time:Naïve hMPV | Diseased:15hrs	
SUBJECT_SAMPLE_FACTORS           	-	S00017206	Time:Naïve hMPV | Diseased:15hrs	
SUBJECT_SAMPLE_FACTORS           	-	S00017207	Time:Naïve hMPV | Diseased:15hrs	
SUBJECT_SAMPLE_FACTORS           	-	S00017208	Time:Naïve hMPV | Diseased:24hrs	
SUBJECT_SAMPLE_FACTORS           	-	S00017209	Time:Naïve hMPV | Diseased:24hrs	
SUBJECT_SAMPLE_FACTORS           	-	S00017210	Time:Naïve hMPV | Diseased:24hrs	
SUBJECT_SAMPLE_FACTORS           	-	S00017202	Time:Naïve hMPV | Diseased:6hrs	
SUBJECT_SAMPLE_FACTORS           	-	S00017203	Time:Naïve hMPV | Diseased:6hrs	
SUBJECT_SAMPLE_FACTORS           	-	S00017204	Time:Naïve hMPV | Diseased:6hrs	
SUBJECT_SAMPLE_FACTORS           	-	S00017187	Time:RSV | Diseased:0hr	
SUBJECT_SAMPLE_FACTORS           	-	S00017188	Time:RSV | Diseased:0hr	
SUBJECT_SAMPLE_FACTORS           	-	S00017189	Time:RSV | Diseased:0hr	
SUBJECT_SAMPLE_FACTORS           	-	S00017193	Time:RSV | Diseased:15hrs	
SUBJECT_SAMPLE_FACTORS           	-	S00017194	Time:RSV | Diseased:15hrs	
SUBJECT_SAMPLE_FACTORS           	-	S00017195	Time:RSV | Diseased:15hrs	
SUBJECT_SAMPLE_FACTORS           	-	S00017196	Time:RSV | Diseased:24hrs	
SUBJECT_SAMPLE_FACTORS           	-	S00017197	Time:RSV | Diseased:24hrs	
SUBJECT_SAMPLE_FACTORS           	-	S00017198	Time:RSV | Diseased:24hrs	
SUBJECT_SAMPLE_FACTORS           	-	S00017190	Time:RSV | Diseased:6hrs	
SUBJECT_SAMPLE_FACTORS           	-	S00017191	Time:RSV | Diseased:6hrs	
SUBJECT_SAMPLE_FACTORS           	-	S00017192	Time:RSV | Diseased:6hrs	
#COLLECTION
CO:SAMPLE_TYPE                   	Cells, Cultured
CO:COLLECTION_SUMMARY            	-
#TREATMENT
TR:TREATMENT_SUMMARY             	-
#SAMPLEPREP
SP:SAMPLEPREP_PROTOCOL_FILENAME  	Gly-TCA-nucleotides_analysis_protocol-2015-03-09.docx
SP:SAMPLEPREP_SUMMARY            	-
#CHROMATOGRAPHY
CH:METHODS_ID                    	AQM020
CH:METHODS_FILENAME              	QTOF-002-HILIC-35min-1mm-No_Insert.m
CH:INSTRUMENT_NAME               	Agilent 1260
CH:COLUMN_NAME                   	Phenomenex Luna NH2 (150 x 1mm, 3um)
CH:CHROMATOGRAPHY_TYPE           	HILIC
#ANALYSIS
AN:LABORATORY_NAME               	MRC2 (University of Michigan)
AN:ANALYSIS_TYPE                 	MS
AN:ACQUISITION_PARAMETERS_FILE   	QTOF-002-HILIC-35min-1mm-No_Insert.m
#MS
MS:MS_COMMENTS                   	-
MS:INSTRUMENT_NAME               	Agilent 6530 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	S00017199	S00017200	S00017201	S00017205	S00017206	S00017207	S00017208	S00017209	S00017210	S00017202	S00017203	S00017204	S00017187	S00017188	S00017189	S00017193	S00017194	S00017195	S00017196	S00017197	S00017198	S00017190	S00017191	S00017192
Factors	Time:Naïve hMPV | Diseased:0hr	Time:Naïve hMPV | Diseased:0hr	Time:Naïve hMPV | Diseased:0hr	Time:Naïve hMPV | Diseased:15hrs	Time:Naïve hMPV | Diseased:15hrs	Time:Naïve hMPV | Diseased:15hrs	Time:Naïve hMPV | Diseased:24hrs	Time:Naïve hMPV | Diseased:24hrs	Time:Naïve hMPV | Diseased:24hrs	Time:Naïve hMPV | Diseased:6hrs	Time:Naïve hMPV | Diseased:6hrs	Time:Naïve hMPV | Diseased:6hrs	Time:RSV | Diseased:0hr	Time:RSV | Diseased:0hr	Time:RSV | Diseased:0hr	Time:RSV | Diseased:15hrs	Time:RSV | Diseased:15hrs	Time:RSV | Diseased:15hrs	Time:RSV | Diseased:24hrs	Time:RSV | Diseased:24hrs	Time:RSV | Diseased:24hrs	Time:RSV | Diseased:6hrs	Time:RSV | Diseased:6hrs	Time:RSV | Diseased:6hrs	
2 or 3-phosphoglycerate_2PG/3PG	3.0300	5.4715	3.9140	3.6314	3.5102	1.6687	2.7495	3.5634	3.2931	3.8788	4.4251	3.1348	3.2089	1.3745	3.2108	1.7846	2.3568	1.8794	3.4603	4.6491	4.1465	7.1894	6.7714	4.9152
6-Phosphogluconate	11.2016	6.9106	7.9103	8.3289	9.8612	8.3304	5.1610	7.8513	6.7206	4.2251	7.0076	10.4958	5.4017	2.6461	5.1609	2.7782	5.5029	3.8079	2.1807	2.8040	2.2602	6.3570	4.4971	5.9374
Acetyl-CoA	2.0885	2.4832	2.1906	2.2873	2.0760	1.8607	0.5350	0.8296	1.3399	1.2945	2.5515	1.9818	1.6383	0.6995	1.5705	4.4657	4.3742	5.0509	3.4607	4.4356	3.9344	3.5173	3.4994	3.1345
ADP	156.9476	94.3725	76.4735	146.7061	121.4355	157.0258	68.2238	72.7214	61.0428	95.3284	118.9152	121.5772	68.8920	27.2780	64.7285	144.7680	140.5737	139.1232	70.9224	74.6783	73.0232	56.4323	62.0778	81.9420
AMP	1013.9323	195.3187	128.7634	1001.8170	504.2473	1200.3625	476.9515	389.8142	156.9215	408.2648	409.3769	526.3854	170.9564	65.9886	210.6911	2087.0643	1988.0352	2699.3845	1895.3751	2385.7660	1928.7641	68.8622	74.4723	147.2613
ATP	520.2769	891.0719	833.5854	471.1378	473.3308	411.7341	151.5543	244.8801	327.8363	491.8458	623.7565	460.9522	722.4480	277.5184	588.2159	123.2453	143.4473	115.8510	65.1435	76.3267	71.2992	1086.3231	870.6704	283.5875
Citrate or Isocitrate	19.8156	25.6571	21.2174	32.9692	30.6935	36.0956	17.8032	22.0665	22.8061	15.0191	19.4379	14.9865	19.7685	7.6025	19.3274	22.8480	23.1566	28.1139	12.5244	13.8489	11.8740	18.8842	15.9767	16.5737
Erythrose 4-phosphate	33.7402	26.1983	26.2469	35.6549	40.9327	32.0901	29.0113	13.6360	34.5854	32.4340	35.6971	29.6916	28.4341	9.6746	25.7083	16.6929	20.1388	19.4057	23.8711	14.5543	23.3222	29.2177	14.7612	29.3856
flavin adenine dinucleotide	0.6511	0.7326	0.7093	0.8179	0.7441	0.8495	0.4957	0.4954	0.5468	0.7318	0.8209	0.6944	0.6466	0.2268	0.4967	0.8298	0.8192	0.9400	0.8548	0.8068	0.8694	0.9247	0.8010	0.6494
Fructose 1_6-bisphosphate	45.2090	85.5564	82.3507	26.9921	22.5788	18.4754	16.4796	24.5820	27.7648	43.8481	57.6367	56.5934	46.8487	20.3622	57.0509	16.7323	25.4952	21.5286	22.0464	39.9983	43.8452	147.8405	131.1691	94.7269
Glucose 6-phosphate or fructose-6-phosphate	35.0492	27.1784	22.4700	65.5903	53.9854	59.6978	49.4604	37.8590	34.0526	32.8442	42.3670	31.5440	31.7386	11.3993	30.4676	27.5218	28.8893	24.7298	19.6649	22.8095	19.8898	23.7801	19.6896	24.8745
Malate	58.4253	71.9577	56.2756	67.4665	57.8685	65.1530	46.4288	59.3166	57.2419	68.1135	73.3895	56.8575	58.5618	20.5604	51.0829	72.1114	83.4297	93.2154	56.5770	64.8125	58.1530	84.4214	66.0436	76.2643
Nicotinamide Adenine Dinucleotide oxidized	19.8095	27.1996	21.0416	21.9719	20.1667	22.6767	12.1419	14.4904	15.1871	22.9528	26.4703	21.9052	18.4673	6.2626	16.6286	19.4022	21.8996	24.6445	14.8864	16.4953	14.9003	30.1234	23.5648	25.3027
nicotinamide adenine dinucleotide phosphate oxidized	3.5198	5.5322	5.3970	2.5397	2.5059	1.4448	1.5613	1.8880	2.0055	1.5534	2.0581	3.2427	1.3624	0.6680	1.3088	1.4790	1.5163	1.5189	1.3536	1.4970	1.3361	3.0789	4.0192	2.7437
nicotinamide adenine dinucleotide phosphate reduced	10.6056	8.0767	6.2390	2.7090	2.6029	9.1028			0.6922	19.6481	22.1884	10.3575	18.8808	6.6410	17.0540	5.0951	6.3317	5.7507	1.2540			27.2657	15.3741	13.5275
Nicotinamide Adenine Dinucleotide reduced	43.7542	34.3515	34.1199	40.7022	31.8218	30.1386	10.8743	12.1345	13.7749	93.7257	80.1129	68.5581	79.4575	28.7480	66.7433	77.5181	79.4167	75.6926	101.4091	128.2782	116.1678	104.2243	61.9185	78.3299
Phosphoenolpyruvate	7.9949	4.7296	4.3713							5.6974	6.5495	4.8010	3.4416	1.7023	4.4648	2.5391	2.6348			7.8831	11.2386	7.5974	10.2154	4.3632
Ribose-5-phosphate or xylulose 5-phosphate	13.0827	9.9636	7.1437	15.5960	18.2411	13.2531	18.6881	10.9257	12.5797	12.7129	15.7034	13.5468	11.5622	4.9760	12.3311	22.6139	21.6020	22.4172	30.7762	33.0507	33.8291	10.5946	8.8118	13.6197
Sedoheptulose 7-phosphate	9.1243	7.3298	6.2979	10.7133	8.9785	11.4845	9.3430	5.6806	5.7692	8.7814	10.9505	7.7231	5.9658	2.1710	5.4145	13.3929	12.6234	12.2528	12.9555	14.0485	14.5414	10.0836	7.2228	7.4353
Sucrose	4.2274	4.1683	1.7222	2.6639	2.1311	3.1732	2.1182	2.0213	0.6399	2.5950	3.4461	1.9254	2.1833	0.7031	2.4312		1.6727			2.2318	2.5756	4.8353	3.7254
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name	pubchem_id	inchi_key	kegg_id	other_id	other_id_type	ri	ri_type	moverz_quant	
2 or 3-phosphoglycerate_2PG/3PG	724		C00597	2PG/3PG	UM_Target_ID				
6-Phosphogluconate	91493		C00345	6PG	UM_Target_ID				
Acetyl-CoA	444493		C00024	aCoA	UM_Target_ID				
ADP	6022		C00008	ADP	UM_Target_ID				
AMP	6083		C00020	AMP	UM_Target_ID				
ATP	5957		C00002	ATP	UM_Target_ID				
Citrate or Isocitrate	311		C00158	CIT/ICIT	UM_Target_ID				
Erythrose 4-phosphate	122357		C00279	E4P	UM_Target_ID				
flavin adenine dinucleotide	643975		C00016	FAD	UM_Target_ID				
Fructose 1,6-bisphosphate	172313		C00354	FBP	UM_Target_ID				
Glucose 6-phosphate or fructose-6-phosphate	5958		C00092	G6P/F6P	UM_Target_ID				
Malate	222656		C00149	MAL	UM_Target_ID				
Nicotinamide Adenine Dinucleotide oxidized	10897651		C00003	NAD	UM_Target_ID				
nicotinamide adenine dinucleotide phosphate oxidized	5886		C00006	NADP	UM_Target_ID				
nicotinamide adenine dinucleotide phosphate reduced	5886		C00006	NADPH	UM_Target_ID				
Nicotinamide Adenine Dinucleotide reduced	439153		C00004	NADH	UM_Target_ID				
Phosphoenolpyruvate	1005		C00074	PEP	UM_Target_ID				
Ribose-5-phosphate or xylulose 5-phosphate	77982		C00117	R5P/X5P	UM_Target_ID				
Sedoheptulose 7-phosphate	165007		C05382	S7P	UM_Target_ID				
Sucrose	5988		C00089	SUC	UM_Target_ID				
METABOLITES_END
#END