#METABOLOMICS WORKBENCH taonotky_20241201_010906 DATATRACK_ID:5414 STUDY_ID:ST003658 ANALYSIS_ID:AN006008 PROJECT_ID:PR002268
VERSION             	1
CREATED_ON             	January 9, 2025, 1:16 am
#PROJECT
PR:PROJECT_TITLE                 	Role of lipid-metabolizing enzyme PNPLA6 in retinal pigment epithelial cells and
PR:PROJECT_TITLE                 	its mechanism of homeostasis
PR:PROJECT_SUMMARY               	PNPLA6 deficiency in the retina has been clinically reported to be a cause of
PR:PROJECT_SUMMARY               	retinitis pigmentosa, a disease leading to blindness. PNPLA6 is generally known
PR:PROJECT_SUMMARY               	to be an enzyme that degrades phospholipids in a calcium-independent manner, but
PR:PROJECT_SUMMARY               	its activity and substrates in the eye have not yet been elucidated. We focused
PR:PROJECT_SUMMARY               	on the function of PNPLA6, whose function in the retina is not well understood,
PR:PROJECT_SUMMARY               	and biochemically analyzed the mechanism by which retinal pigmentary
PR:PROJECT_SUMMARY               	degeneration occurs.
PR:INSTITUTE                     	University of Tokyo
PR:LAST_NAME                     	Ono
PR:FIRST_NAME                    	Takashi
PR:ADDRESS                       	7-3-1, Hongo, Bunkyo-ku
PR:EMAIL                         	taono-tky@umin.ac.jp
PR:PHONE                         	+81-338155411
#STUDY
ST:STUDY_TITLE                   	Functional analysis of retinal pigment epithelial cells with PNPLA6 knockdown
ST:STUDY_SUMMARY                 	PNPLA6 was knocked down using siRNA on ARPE-19, a representative cultured cell
ST:STUDY_SUMMARY                 	line of human retinal pigment epithelial cells. Lipid analysis of the
ST:STUDY_SUMMARY                 	constituent phospholipids was performed on these cells, comparing them to a
ST:STUDY_SUMMARY                 	group treated with scramble siRNA. We also overexpressed PNPLA6 in human retinal
ST:STUDY_SUMMARY                 	pigment epithelial cells ARPE-19 and performed the same lipid analysis.
ST:INSTITUTE                     	University of Tokyo
ST:LAST_NAME                     	Ono
ST:FIRST_NAME                    	Takashi
ST:ADDRESS                       	7-3-1, Hongo, Bunkyo-ku
ST:EMAIL                         	taono-tky@umin.ac.jp
ST:PHONE                         	0338155411
#SUBJECT
SU:SUBJECT_TYPE                  	Cultured cells
SU:SUBJECT_SPECIES               	Homo sapiens
SU:TAXONOMY_ID                   	9606
#FACTORS
#SUBJECT_SAMPLE_FACTORS:         	SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Raw file names and additional sample data
SUBJECT_SAMPLE_FACTORS           	n1	NegKD-1	Sample source:RPE (Retinal pigment epithelium) | Genotype:Wild	Treatment=-; Batch=B1a; RAW_FILE_NAME(RAW_file_name)=MS-n1.mzML
SUBJECT_SAMPLE_FACTORS           	n2	NegKD-2	Sample source:RPE (Retinal pigment epithelium) | Genotype:Wild	Treatment=-; Batch=B1a; RAW_FILE_NAME(RAW_file_name)=MS-n2.mzML
SUBJECT_SAMPLE_FACTORS           	n3	NegKD-3	Sample source:RPE (Retinal pigment epithelium) | Genotype:Wild	Treatment=-; Batch=B1a; RAW_FILE_NAME(RAW_file_name)=MS-n3.mzML
SUBJECT_SAMPLE_FACTORS           	n4	NegKD-4	Sample source:RPE (Retinal pigment epithelium) | Genotype:Wild	Treatment=-; Batch=B1a; RAW_FILE_NAME(RAW_file_name)=MS-n4.mzML
SUBJECT_SAMPLE_FACTORS           	6kd1	PN6KD-1	Sample source:RPE (Retinal pigment epithelium) | Genotype:KD	Treatment=-; Batch=B1a; RAW_FILE_NAME(RAW_file_name)=MS-6kd1.mzML
SUBJECT_SAMPLE_FACTORS           	6kd2	PN6KD-2	Sample source:RPE (Retinal pigment epithelium) | Genotype:KD	Treatment=-; Batch=B1a; RAW_FILE_NAME(RAW_file_name)=MS-6kd2.mzML
SUBJECT_SAMPLE_FACTORS           	6kd3	PN6KD-3	Sample source:RPE (Retinal pigment epithelium) | Genotype:KD	Treatment=-; Batch=B1a; RAW_FILE_NAME(RAW_file_name)=MS-6kd3.mzML
SUBJECT_SAMPLE_FACTORS           	6kd4	PN6KD-4	Sample source:RPE (Retinal pigment epithelium) | Genotype:KD	Treatment=-; Batch=B1a; RAW_FILE_NAME(RAW_file_name)=MS-6kd4.mzML
SUBJECT_SAMPLE_FACTORS           	mock1	mock-1	Sample source:RPE (Retinal pigment epithelium) | Genotype:mock	Treatment=-; Batch=B1a; RAW_FILE_NAME(RAW_file_name)=MS-mock1.mzML
SUBJECT_SAMPLE_FACTORS           	mock2	mock-2	Sample source:RPE (Retinal pigment epithelium) | Genotype:mock	Treatment=-; Batch=B1a; RAW_FILE_NAME(RAW_file_name)=MS-mock2.mzML
SUBJECT_SAMPLE_FACTORS           	mock3	mock-3	Sample source:RPE (Retinal pigment epithelium) | Genotype:mock	Treatment=-; Batch=B1a; RAW_FILE_NAME(RAW_file_name)=MS-mock3.mzML
SUBJECT_SAMPLE_FACTORS           	mock4	mock-4	Sample source:RPE (Retinal pigment epithelium) | Genotype:mock	Treatment=-; Batch=B1a; RAW_FILE_NAME(RAW_file_name)=MS-mock4.mzML
SUBJECT_SAMPLE_FACTORS           	6OE1	PN6OE-1	Sample source:RPE (Retinal pigment epithelium) | Genotype:OE	Treatment=-; Batch=B1a; RAW_FILE_NAME(RAW_file_name)=MS-6OE1.mzML
SUBJECT_SAMPLE_FACTORS           	6OE2	PN6OE-2	Sample source:RPE (Retinal pigment epithelium) | Genotype:OE	Treatment=-; Batch=B1a; RAW_FILE_NAME(RAW_file_name)=MS-6OE2.mzML
SUBJECT_SAMPLE_FACTORS           	6OE3	PN6OE-3	Sample source:RPE (Retinal pigment epithelium) | Genotype:OE	Treatment=-; Batch=B1a; RAW_FILE_NAME(RAW_file_name)=MS-6OE3.mzML
SUBJECT_SAMPLE_FACTORS           	6OE4	PN6OE-4	Sample source:RPE (Retinal pigment epithelium) | Genotype:OE	Treatment=-; Batch=B1a; RAW_FILE_NAME(RAW_file_name)=MS-6OE4.mzML
#COLLECTION
CO:COLLECTION_SUMMARY            	The human RPE cell line ARPE-19 (CRL-2302, ATCC) was cultured in Dulbecco's
CO:COLLECTION_SUMMARY            	Modified Eagle's Medium (DMEM)/F12 and DMEM high glucose , respectively, with
CO:COLLECTION_SUMMARY            	penicillin streptomycin (100 units/ml) and 10% (v/v) fetal bovine serum in a CO2
CO:COLLECTION_SUMMARY            	incubator under 5% (v/v) CO2 at 37°C. Target-specific Silencer® Select siRNAs
CO:COLLECTION_SUMMARY            	(Thermo Fischer Scientific) or a Silencer® Select Negative Control No. 1 siRNA
CO:COLLECTION_SUMMARY            	(4390843, Thermo Fischer Scientific) were transfected into ARPE-19 with
CO:COLLECTION_SUMMARY            	Lipofectamine 3000. Cells were collected once after transfection, re-spread, and
CO:COLLECTION_SUMMARY            	collected 3 days later.
CO:SAMPLE_TYPE                   	Cultured cells
#TREATMENT
TR:TREATMENT_SUMMARY             	Cells were stripped using trypsin EDTA, washed with PBS, and cell counts were
TR:TREATMENT_SUMMARY             	performed with automated cell counter.
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	Total lipids were extracted using the Bligh and Dyer method. After the samples
SP:SAMPLEPREP_SUMMARY            	were dried, 175 µL of digestion reagent (60% HClO: H2SO4 = 1:1 (v/v)) was added
SP:SAMPLEPREP_SUMMARY            	to the samples or a phosphorus standard (NaH2PO4), stirred, and scorched using a
SP:SAMPLEPREP_SUMMARY            	gas burner. After cooling at room temperature, 125 µL of water, 1 mL of 1%
SP:SAMPLEPREP_SUMMARY            	(w/v) ammonium molybdate, and 50 µL of reducing reagent were added and the
SP:SAMPLEPREP_SUMMARY            	samples were boiled for 10 min. The reaction was stopped on ice, and the
SP:SAMPLEPREP_SUMMARY            	absorbance was measured at 750 nm.
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_TYPE           	HILIC
CH:INSTRUMENT_NAME               	LC-30AD
CH:COLUMN_NAME                   	SeQuant ZIC-HILIC (100 x 2.1 mm, 3.5 µm)
CH:SOLVENT_A                     	95% Acetonitrile/5% Water; 10 mM ammonium acetate
CH:SOLVENT_B                     	50% Acetonitrile/50% Water; 20 mM ammonium acetate
CH:FLOW_GRADIENT                 	0–3 min 0% B; 3–6 min 0–60% B; 6–17 min 60–62.2% B; 17–17.01 min
CH:FLOW_GRADIENT                 	62.2–69.8% B; 17.01–20 min 69.8–100% B; 20–23 min 100% B; 23–23.10 min
CH:FLOW_GRADIENT                 	100–0% B; 23.10–26 min 0% B
CH:FLOW_RATE                     	0.2 mL/min
CH:COLUMN_TEMPERATURE            	50°C
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
#MS
MS:INSTRUMENT_NAME               	ABI Sciex 4000 QTrap
MS:INSTRUMENT_TYPE               	QTRAP
MS:MS_TYPE                       	API
MS:ION_MODE                      	POSITIVE
MS:MS_COMMENTS                   	4500 QTRAP LC-MS/MS/MS system (AB Sciex), a triple quadrupole lipid molecular
MS:MS_COMMENTS                   	apparatus, was employed to quantify individual lipid molecules. Lipid samples (5
MS:MS_COMMENTS                   	nmol of phospholipids) or standard lipids (Avanti Polar Lipids), prepared as
MS:MS_COMMENTS                   	previously described, were transferred to vials with added internal standards
MS:MS_COMMENTS                   	for each lipid type. The solvent was then evaporated using nitrogen gas, and the
MS:MS_COMMENTS                   	residue was dissolved in 50 µL of isopropanol:methanol (1:1, v/v) before being
MS:MS_COMMENTS                   	placed in an autosampler. Lipid profiling was conducted using a concurrent
MS:MS_COMMENTS                   	quantification method for phospholipids and lysophospholipids via multiple
MS:MS_COMMENTS                   	reaction monitoring (MRM). MultiQuant software (AB Sciex) was utilized to
MS:MS_COMMENTS                   	analyze the data, yielding peak area under the curve (AUC) values for each lipid
MS:MS_COMMENTS                   	molecule. Quantification of individual lipid species was achieved using
MS:MS_COMMENTS                   	calibration curves generated from AUCs obtained at LC elution times matching
MS:MS_COMMENTS                   	those of the standard lipids.
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS	nmol/10^6 cells
MS_METABOLITE_DATA_START
Samples	NegKD-1	NegKD-2	NegKD-3	NegKD-4	PN6KD-1	PN6KD-2	PN6KD-3	PN6KD-4
Factors	Sample source:RPE (Retinal pigment epithelium) | Genotype:Wild	Sample source:RPE (Retinal pigment epithelium) | Genotype:Wild	Sample source:RPE (Retinal pigment epithelium) | Genotype:Wild	Sample source:RPE (Retinal pigment epithelium) | Genotype:Wild	Sample source:RPE (Retinal pigment epithelium) | Genotype:KD	Sample source:RPE (Retinal pigment epithelium) | Genotype:KD	Sample source:RPE (Retinal pigment epithelium) | Genotype:KD	Sample source:RPE (Retinal pigment epithelium) | Genotype:KD
LPC 16:0	4901678.002	4354088.779	4977222.81	4193371.477	6244821.809	5941081.084	5088736.799	5831746.468
LPC 16:1	391015.2988	312431.0667	370566.7106	340505.271	520395.7498	421152.8802	407764.7858	455266.9705
LPC 17:0	361023.5445	309166.9209	372762.9602	312842.2384	533606.1016	444928.3585	437690.1149	478295.8901
LPC 18:0	4879619.882	4270381.329	5324235.837	4303610.17	7192406.563	5711670.64	5518903.408	6227195.453
LPC 18:1	3179939.122	2600375.747	3024300.528	2699631.253	4654169.006	3881783.299	3450029.822	3902567.557
LPC 18:2	303397.7921	277909.7473	352297.3056	282646.0848	419705.6598	368345.2495	283033.2545	368981.2676
LPC 18:3	17148.93913	14149.84147	12332.93607	10873.27235	19855.6308	15371.68239	20690.42363	16896.64053
LPC 20:0	110836.7341	107055.5117	124182.2355	109078.5376	173695.6094	132921.29	137931.6453	146186.4789
LPC 20:1	176649.9745	135928.1705	153604.716	167664.847	235154.1166	181273.5184	170923.7694	185243.7437
LPC 20:2	99084.92204	88232.0957	96006.50147	84802.77245	126888.2433	98906.85297	83733.47007	94263.71603
LPC 20:3	357467.6422	258016.9798	314922.9483	331376.3205	501332.2239	393848.7752	355324.499	442286.5995
LPC 20:4	579093.4202	475792.5751	549215.3172	491047.3665	779347.1051	660815.8869	672629.1808	740027.1422
LPC 20:5	40895.93418	25099.23043	29230.33624	20133.28707	67008.74654	45840.21171	53480.23054	36230.81547
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name	Retention index	m/z
LPC 16:0	10.73212685	496.3
LPC 16:1	10.74750604	494.3
LPC 17:0	10.77570914	510.3
LPC 18:0	10.59116749	524.3
LPC 18:1	10.50917107	522.3
LPC 18:2	10.79771404	520.3
LPC 18:3	10.93419458	518.3
LPC 20:0	10.59108428	552.3
LPC 20:1	10.59759584	550.3
LPC 20:2	10.5230088	548.3
LPC 20:3	10.8629894	546.3
LPC 20:4	10.6031658	544.3
LPC 20:5	10.5644	542.3
METABOLITES_END
#END