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. Author manuscript; available in PMC: 2019 May 1.
Published in final edited form as: J Chromatogr B Analyt Technol Biomed Life Sci. 2018 Mar 21;1084:132–140. doi: 10.1016/j.jchromb.2018.03.031

Table 1.

Proteins and peptides selection for inclusion in quantitative assay. Proteins were chosen based on results from previous studies and are listed based on retention time. SpectrumMill MRM and Skyline were used to choose initial peptides and transitions. Precursor ions (Prec Ion), fragmentation voltage (CEV), Product Ions, and Ion fragments are shown for each peptide. Transitions for endogenous peptides are highlighted in grey, labeled peptides are shown in white.

Peptide, protein name, accession # RT Prec Ion CE (V) Product Ion Ion fragment
LAQAYYESTR Filaggrin I P20930 5.14 601.3 16.8 889.4 y7
655.3 y5
LAQAYYESTR* Filaggrin I P20930 (AQUA) 606.3 16.8 899.4 y7
665.3 y5
IILQPCGSK (alk) Corneodesmosin Q15517 6.44 508.3 13.5 789.4 y7
548.2 y5
IILQPCGSK* (alk) Corneodesmosin Q15517 (AQUA) 512.3 13.5 797.4 y7
556.3 y5
TTQFSCTLGEK (alk) Fatty Acid Binding Protein Q01469 6.52 636.3 18.1 941.4 y8
794.4 y7
TTQFSCTLGEK* (alk) Fatty Acid Binding Protein Q01469 (AQUA) 640.3 18.1 949.5 y8
802.4 y7
TNSILFYGR Serpin B3 P29508 9.65 535.8 14.5 855.5 y7
655.4 y5
TNSILFYGR* Serpin B3 P29508 (AQUA) 540.8 14.5 865.5 y7
665.4 y5
ITWLYDNTTGK Transglutaminase 3 Q08188 10.09 656.3 18.8 911.4 y8
798.4 y7
ITWLYDNTTGK* Transglutaminase 3 Q08188 (AQUA) 660.3 18.8 919.5 y8
806.4 y7
ELGVGIALR Fatty Acid Binding Protein Q01469 10.49 464.3 11.9 685.4 y7
529.3 y6
ELGVGIALR* Fatty Acid Binding Protein Q01469 (AQUA) 469.3 11.9 695.4 y7
539.4 y6
FYQTSVESVDFANAPEESR Serpin B3 P29508 10.7 726.0 21.3 802.4 y7
617.3 y5
FYQTSVESVDFANAPEESR* Serpin B3 P29508 (AQUA) 729.3 21.3 812.4 y7
627.3 y5
GSPGVPSFAAGPPISEGK Corneodesmosin Q15517 10.88 827.9 25 755.9 y16++
629.3 y13++
GSPGVPSFAAGPPISEGK* Corneodesmosin Q15517 (AQUA) 831.9 25 759.9 y16++
633.3 y13++
GNPTVEVDLFTSK Alpha enolase P06733 11.38 703.9 20.5 938.5 y8
618.3 y11++
GNPTVEVDLFTSK* Alpha enolase P06733 (AQUA) 707.9 20.5 946.5 y8
622.3 y11++
SQGVFQCGPASVIGVR (alk) Transglutaminase 3 Q08188 11.78 831.4 25.1 1015.5 y10
855.5 y9
SQGVFQCGPASVIGVR* (alk) Transglutaminase 3 Q08188 (AQUA) 836.4 25.1 1025.5 y10
865.5 y9
AAVPSGASTGIYEALELR Alpha enolase P06733 13.56 903.0 27.7 1164.6 y10
1063.6 y9
AAVPSGASTGIYEALELR* Alpha enolase P06733 (AQUA) 908.0 27.7 1174.6 y10
1073.6 y9
SVVTVIDVFYK Filaggrin 2 Q5D862 14.9 635.4 16.8 984.5 y8
784.4 y6
SVVTVIDVFYK* Filaggrin 2 Q5D862 AQUA (AQUA) 639.4 16.8 992.6 y8
792.4 y6
NPDDPDMVDVFMDHLDIDHNK Filaggrin I P20930 15.43 621.3 17.6 799.9 y13++
741.4 y6
NPDDPDMVDVFMDHLDIDHNK*Filaggrin I P20930 (AQUA) 623.3 17.6 803.9 y13++
749.4 y6
NPDDPDTVDVIMHMLDR Filaggrin 2 Q5D862 16.19 661.6 27.4 771.4 y13++
623.6 y16+++
NPDDPDTVDVIMHMLDR* Filaggrin 2 Q5D862 (AQUA) 665.0 27.4 776.4 y13++
627.0 y16+++