Theoretical evaluation of peak capacity improvements by use of liquid chromatography combined with drift tube ion mobility-mass spectrometry

Journal of Chromatography A

Volumn 1416, Issue , 2015, Pages 47-56

  Causon, Tim J ^a   Hann, Stephan ^a  

^a UNIVERSITY OF NATURAL RESOURCES AND LIFE SCIENCES   (Austria)

Author keywords

High performance liquid chromatography; Ion mobility; Metabolomics; Multidimensional separations; Non targeted

Indexed keywords

COLUMN CHROMATOGRAPHY; DRIFT CHAMBERS; HIGH PERFORMANCE LIQUID CHROMATOGRAPHY; ION CHROMATOGRAPHY; IONS; LIQUIDS; MASS SPECTROMETERS; MASS SPECTROMETRY; SEPARATION; TUBES (COMPONENTS);

CHROMATOGRAPHIC SEPARATIONS; ION MOBILITY; ION MOBILITY SPECTROMETRY; ION MOBILITY-MASS SPECTROMETRY; MASS SPECTROMETRIC DETECTION; METABOLOMICS; MULTIDIMENSIONAL SEPARATIONS; NON-TARGETED;

ION MOBILITY SPECTROMETERS;

ARTICLE; CONTROLLED STUDY; DILUTION; HIGH PERFORMANCE LIQUID CHROMATOGRAPHY; ION MOBILITY SPECTROMETRY; MASS SPECTROMETRY; METABOLOMICS; PEAK CAPACITY; PHYSICAL PARAMETERS; PRIORITY JOURNAL; PROTEOMICS; THEORETICAL STUDY; WORKFLOW; EVALUATION STUDY; HUMAN; PROCEDURES; THEORETICAL MODEL;

ION; LIPID;

CHROMATOGRAPHY, HIGH PRESSURE LIQUID; HUMANS; IONS; LIPIDS; MASS SPECTROMETRY; METABOLOMICS; MODELS, THEORETICAL; PROTEOMICS;

EID: 84942192298     PISSN: 00219673     EISSN: 18733778     Source Type: Journal    
DOI: 10.1016/j.chroma.2015.09.009     Document Type: Article

References (66)

1. Guiochon G. Comparison of the theoretical limits of separating speed in liquid and gas chromatography. Anal. Chem. 1980, 52:2002-2008. http://dx.doi.org/10.1021/ac50063a004.
2. Neue U.D. Theory of peak capacity in gradient elution. J. Chromatogr. A 2005, 1079:153-161. 10.1016/j.chroma.2005.03.008.
3. Wang X., Stoll D.R., Carr P.W., Schoenmakers P.J. A graphical method for understanding the kinetics of peak capacity production in gradient elution liquid chromatography. J. Chromatogr. A 2006, 1125:177-181. http://dx.doi.org/10.1016/j.chroma.2006.05.048.
4. Neue U.D. Peak capacity in unidimensional chromatography. J. Chromatogr. A 2008, 1184:107-130. http://dx.doi.org/10.1016/j.chroma.2007.11.113.
5. Potts L.W., Carr P.W. Approximate and exact equations for peak capacity in isocratic high-pressure liquid chromatography. Anal. Chem. 2011, 83:7614-7615. 10.1021/ac202102s.
6. Chester T.L. Further considerations of exact equations for peak capacity in isocratic liquid chromatography. Anal. Chem. 2014, 86:7239-7241. 10.1021/ac502005a.
7. Guiochon G. The limits of the separation power of unidimensional column liquid chromatography. J. Chromatogr. A 2006, 1126:6-49. 10.1016/j.chroma.2006.07.032.
8. 6 theoretical plates in liquid chromatography using very long pillar array columns. Anal. Chem. 2011, 84:1214-1219. 10.1021/ac203048n.
9. Eeltink S., Dolman S., Swart R., Ursem M., Schoenmakers P.J. Optimizing the peak capacity per unit time in one-dimensional and off-line two-dimensional liquid chromatography for the separation of complex peptide samples. J. Chromatogr. A 2009, 1216:7368-7374. 10.1016/j.chroma.2009.02.075.
10. Horváth K., Fairchild J.N., Guiochon G. Generation and limitations of peak capacity in online two-dimensional liquid chromatography. Anal. Chem. 2009, 81:3879-3888. 10.1021/ac802694c.
11. Vaast A., De Vos J., Broeckhoven K., Verstraeten M., Eeltink S., Desmet G. Maximizing the peak capacity using coupled columns packed with 2.6μm core-shell particles operated at 1200bar. J. Chromatogr. A 2012, 1256:72-79. 10.1016/j.chroma.2012.07.031.
12. Soliven A., Haidar Ahmad I.A., Filgueira M.R., Carr P.W. Optimization of gradient reversed phase chromatographic peak capacity for low molecular weight solutes. J. Chromatogr. A 2013, 1273:57-65. 10.1016/j.chroma.2012.11.068.
13. Davis J.M., Giddings J.C. Statistical theory of component overlap in multicomponent chromatograms. Anal. Chem. 1983, 55:418-424. 10.1021/ac00254a003.
14. Giddings J.C. Concepts and comparisons in multidimensional separation. J. High Resolut. Chromatogr. 1987, 10:319-323. 10.1002/jhrc.1240100517.
15. Stoll D.R., Carr P.W. Fast, comprehensive two-dimensional HPLC separation of tryptic peptides based on high-temperature HPLC. J. Am. Chem. Soc. 2005, 127:5034-5035. 10.1021/ja050145b.
16. Stoll D.R., Cohen J.D., Carr P.W. Fast, comprehensive online two-dimensional high performance liquid chromatography through the use of high temperature ultra-fast gradient elution reversed-phase liquid chromatography. J. Chromatogr. A 2006, 1122:123-137. 10.1016/j.chroma.2006.04.058.
17. Potts L.W., Stoll D.R., Li X., Carr P.W. The impact of sampling time on peak capacity and analysis speed in on-line comprehensive two-dimensional liquid chromatography. J. Chromatogr. A 2010, 1217:5700-5709. 10.1016/j.chroma.2010.07.009.
18. Gu H., Huang Y., Carr P.W. Peak capacity optimization in comprehensive two dimensional liquid chromatography: A practical approach. J. Chromatogr. A 2011, 1218:64-73. 10.1016/j.chroma.2010.10.096.
19. Talus E.S., Witt K.E., Stoll D.R. Effect of pressure pulses at the interface valve on the stability of second dimension columns in online comprehensive two-dimensional liquid chromatography. J. Chromatogr. A 2015, 1378:50-57. 10.1016/j.chroma.2014.12.019.
20. Stoll D.R., O'Neill K., Harmes D.C. Effects of pH mismatch between the two dimensions of reversed-phase×reversed-phase two-dimensional separations on second dimension separation quality for ionogenic compounds-I. Carboxylic acids. J. Chromatogr. A 2015, 1383:25-34. 10.1016/j.chroma.2014.12.054.
21. Donato P., Cacciola F., Sommella E., Fanali C., Dugo L., Dachà M., et al. Online comprehensive RPLC×RPLC with mass spectrometry detection for the analysis of proteome samples. Anal. Chem. 2011, 83:2485-2491. 10.1021/ac102656b.
22. Guiochon G., Marchetti N., Mriziq K., Shalliker R.A. Implementations of two-dimensional liquid chromatography. J. Chromatogr. A 2008, 1189:109-168. 10.1016/j.chroma.2008.01.086.
23. Wouters B., De Vos J., Desmet G., Terryn H., Schoenmakers P.J., Eeltink S. Design of a microfluidic device for comprehensive spatial two-dimensional liquid chromatography. J. Sep. Sci. 2015, 10.1002/jssc.201401192.
24. Bushey M.M., Jorgenson J.W. Automated instrumentation for comprehensive two-dimensional high-performance liquid chromatography/capillary zone electrophoresis. Anal. Chem. 1990, 62:978-984. http://dx.doi.org/10.1021/ac00209a002.
25. Kanu A.B., Dwivedi P., Tam M., Matz L., Hill H.H. Ion mobility-mass spectrometry. J. Mass Spectrom. 2008, 43:1-22. 10.1002/jms.1383.
26. May J.C., McLean J.A. Ion mobility-mass spectrometry: time-dispersive instrumentation. Anal. Chem. 2015, 87:1422-1436. 10.1021/ac504720m.
27. Lewis K.C., Opiteck G.J., Jorgenson J.W., Sheeley D.M. Comprehensive on-line RPLC-CZE-MS of peptides. J. Am. Soc. Mass Spectrom. 1997, 8:495-500. 10.1016/S1044-0305(97)00009-3.
28. Shen Y., Tolić N., Zhao R., Paša-Tolić L., Li L., Berger S.J., et al. High-throughput proteomics using high-efficiency multiple-capillary liquid chromatography with on-line high-performance ESI FTICR mass spectrometry. Anal. Chem. 2001, 73:3011-3021. 10.1021/ac001393n.
29. Valentine S.J., Kulchania M., Barnes C.A.S., Clemmer D.E. Multidimensional separations of complex peptide mixtures: a combined high-performance liquid chromatography/ion mobility/time-of-flight mass spectrometry approach. Int. J. Mass Spectrom. 2001, 212:97-109. 10.1016/S1387-3806(01)00511-5.
30. Ruotolo B.T., McLean J.A., Gillig K.J., Russell D.H. Peak capacity of ion mobility-mass spectrometry: the utility of multiple bath gases for peptide separation 2002, 83-84.
31. Ruotolo B.T., Gillig K.J., Stone E.G., Russell D.H. Peak capacity of ion mobility mass spectrometry: Separation of peptides in helium buffer gas. J. Chromatogr. B Anal. Technol. Biomed. Life. Sci. 2002, 782:385-392. 10.1016/S1570-0232(02)00566-4.
32. Ruotolo B.T., McLean J.A., Gillig K.J., Russell D.H. Peak capacity of ion mobility mass spectrometry: the utility of varying drifts gas polarizability for the separation of tryptic peptides. J. Mass Spectrom. 2004, 39:361-367. 10.1002/jms.592.
33. Merenbloom S.I., Bohrer B.C., Koeniger S.L., Clemmer D.E. Assessing the peak capacity of IMS-IMS separations of tryptic peptide ions in He at 300K. Anal. Chem. 2007, 79:515-522. 10.1021/ac061567m.
34. Varesio E., Blanc J.C.Y.L., Hopfgartner G. Real-time 2D separation by LC×differential ion mobility hyphenated to mass spectrometry. Anal. Bioanal. Chem. 2012, 402:2555-2564. 10.1007/s00216-011-5444-y.
35. Calvin Giddings J. Dynamics of Chromatography, New York 1965.
36. Horvath C.G., Lipsky S.R. Peak capacity in chromatography. Anal. Chem. 1967, 39. 1893-1893. 10.1021/ac50157a075.
37. Dolan J.W., Snyder L.R., Djordjevic N.M., Hill D.W., Waeghe T.J. Reversed-phase liquid chromatographic separation of complex samples by optimizing temperature and gradient time I. Peak capacity limitations. J. Chromatogr. A 1999, 857:1-20. 10.1016/S0021-9673(99)00765-7.
38. De Vos J., Stassen C., Vaast A., Desmet G., Eeltink S. High-resolution separations of tryptic digest mixtures using core-shell particulate columns operated at 1200bar. J. Chromatogr. A 2012, 1264:57-62. 10.1016/j.chroma.2012.09.065.
39. Gritti F., Guiochon G. Optimization of the peak capacity per unit time. J. Chromatogr. A 2012, 1263:125-140. 10.1016/j.chroma.2012.09.040.
40. Guillarme D., Grata E., Glauser G., Wolfender J.-L., Veuthey J.-L., Rudaz S. Some solutions to obtain very efficient separations in isocratic and gradient modes using small particles size and ultra-high pressure. J. Chromatogr. A 2009, 1216:3232-3243. 10.1016/j.chroma.2009.02.032.
41. Revercomb H.E., Mason E.A. Theory of plasma chromatography/gaseous electrophoresis - a review. Anal. Chem. 1975, 47:970-983.
42. Rokushika S., Hatano H., Baim M.A., Hill H.H. Resolution measurement for ion mobility spectrometry. Anal. Chem. 1985, 57:1902-1907. 10.1021/ac00286a023.
43. Kanu A.B., Gribb M.M., Hill H.H. Predicting optimal resolving power for ambient pressure ion mobility spectrometry. Anal. Chem. 2008, 80:6610-6619. 10.1021/ac8008143.
44. Grushka E. Chromatographic peak capacity and the factors influencing it. Anal. Chem. 1970, 42:1142-1147. 10.1021/ac60293a001.
45. Shen Y., Lee M.L. General equation for peak capacity in column chromatography. Anal. Chem. 1998, 70:3853-3856. 10.1021/ac9802426.
46. Valkó K., Snyder L.R., Glajch J.L. Retention in reversed-phase liquid chromatography as a function of mobile-phase composition. J. Chromatogr. A 1993, 656:501-520. 10.1016/0021-9673(93)80816-Q.
47. Poppe H. Some reflections on speed and efficiency of modern chromatographic methods. J. Chromatogr. A 1997, 778:3-21. 10.1016/S0021-9673(97)00376-2.
48. Fekete S., Oláh E., Fekete J. Fast liquid chromatography: the domination of core-shell and very fine particles. J. Chromatogr. A 2012, 1228:57-71. 10.1016/j.chroma.2011.09.050.
49. Wang X., Stoll D.R., Schellinger A.P., Carr P.W. Peak capacity optimization of peptide separations in reversed-phase gradient elution chromatography: fixed column format. Anal. Chem. 2006, 78:3406-3416. 10.1021/ac0600149.
50. Broeckhoven K., Cabooter D., Lynen F., Sandra P., Desmet G. The kinetic plot method applied to gradient chromatography: theoretical framework and experimental validation. J. Chromatogr. A 2010, 1217:2787-2795. 10.1016/j.chroma.2010.02.023.
51. May J.C., Goodwin C.R., Lareau N.M., Leaptrot K.L., Morris C.B., Kurulugama R.T., et al. Conformational ordering of biomolecules in the gas phase: nitrogen collision cross sections measured on a prototype high resolution drift tube ion mobility-mass spectrometer. Anal. Chem. 2014, 86:2107-2116. 10.1021/ac4038448.
52. Paglia G., Angel P., Williams J.P., Richardson K., Olivos H.J., Thompson J.W., et al. Ion mobility-derived collision cross section as an additional measure for lipid fingerprinting and identification. Anal. Chem. 2015, 87:1137-1144. 10.1021/ac503715v.
53. Davis E.J., Williams M.D., Siems W.F., Hill H.H. Voltage sweep ion mobility spectrometry. Anal. Chem. 2011, 83:1260-1267. 10.1021/ac1021002.
54. Asbury G.R., Hill H.H. Using different drift gases to change separation factors (α) in ion mobility spectrometry. Anal. Chem. 2000, 72:580-584. 10.1021/ac9908952.
55. Köcher T., Pichler P., Swart R., Mechtler K. Analysis of protein mixtures from whole-cell extracts by single-run nanoLC-MS/MS using ultralong gradients. Nat. Protoc. 2012, 7:882-890. 10.1038/nprot.2012.036.
56. Crowell K.L., Slysz G.W., Baker E.S., LaMarche B.L., Monroe M.E., Ibrahim Y.M., et al. LC-IMS-MS feature finder: detecting multidimensional liquid chromatography, ion mobility and mass spectrometry features in complex datasets. Bioinformatics 2013, 29:2804-2805. 10.1093/bioinformatics/btt465.
57. Horváth K., Fairchild J.N., Guiochon G. Detection issues in two-dimensional on-line chromatography. J. Chromatogr. A 2009, 1216:7785-7792. 10.1016/j.chroma.2009.09.016.
58. Schoenmakers P.J., Vivó-Truyols G., Decrop W.M.C. A protocol for designing comprehensive two-dimensional liquid chromatography separation systems. J. Chromatogr. A 2006, 1120:282-290. 10.1016/j.chroma.2005.11.039.
59. Fairchild J.N., Horváth K., Guiochon G. Approaches to comprehensive multidimensional liquid chromatography systems. J. Chromatogr. A 2009, 1216:1363-1371. 10.1016/j.chroma.2008.12.073.
60. Paglia G., Williams J.P., Menikarachchi L., Thompson J.W., Tyldesley-Worster R., Halldórsson S., et al. Ion mobility derived collision cross sections to support metabolomics applications. Anal. Chem. 2014, 86:3985-3993. 10.1021/ac500405x.
61. Flick T.G., Campuzano I.D.G., Bartberger M.D. Structural resolution of 4-substituted proline diastereomers with ion mobility spectrometry via alkali metal ion cationization. Anal. Chem. 2015, 87:3300-3307. 10.1021/ac5043285.
62. May J.C., Goodwin C.R., McLean J.A. Ion mobility-mass spectrometry strategies for untargeted systems, synthetic, and chemical biology. Curr. Opin. Biotechnol. 2015, 31:117-121. 10.1016/j.copbio.2014.10.012.
63. Crowell K.L., Baker E.S., Payne S.H., Ibrahim Y.M., Monroe M.E., Slysz G.W., et al. Increasing confidence of LC-MS identifications by utilizing ion mobility spectrometry. Int. J. Mass Spectrom. 2013, 354-355:312-317. 10.1016/j.ijms.2013.06.028.
64. Kajdan T., Cortes H., Kuppannan K., Young S.A. Development of a comprehensive multidimensional liquid chromatography system with tandem mass spectrometry detection for detailed characterization of recombinant proteins. J. Chromatogr. A 2008, 1189:183-195. 10.1016/j.chroma.2007.11.031.
65. Wolters D.A., Washburn M.P., Yates J.R. An automated multidimensional protein identification technology for shotgun proteomics. Anal. Chem. 2001, 73:5683-5690. 10.1021/ac010617e.
66. Opiteck G.J., Lewis K.C., Jorgenson J.W., Anderegg R.J. Comprehensive on-line LC/LC/MS of proteins. Anal. Chem. 1997, 69:1518-1524. 10.1021/ac961155l.