Deciphering β-lactoglobulin interactions at an oil-water interface: A molecular dynamics study

Biomacromolecules

Volumn 16, Issue 6, 2015, Pages 1855-1861

  Zare, Davoud ^a,b   McGrath, Kathryn M ^a,b   Allison, Jane R ^c,d,e  

^a VICTORIA UNIVERSITY OF WELLINGTON   (New Zealand)

^b MASSEY UNIVERSITY   (New Zealand)

^c MASSEY UNIVERSITY   (New Zealand)

^d UNIVERSITY OF CANTERBURY   (New Zealand)

^e MAURICE WILKINS CENTRE FOR MOLECULAR BIODISCOVERY   (New Zealand)

Author keywords

[No Author keywords available]

Indexed keywords

ADSORPTION; OILS AND FATS; PARAFFINS; PHASE INTERFACES; STOCHASTIC SYSTEMS;

ADSORPTION MECHANISM; ATOMISTIC MOLECULAR DYNAMICS SIMULATIONS; DESIGN AND DEVELOPMENT; LIQUID-LIQUID INTERFACES; OIL/WATER INTERFACES; PHARMACEUTICAL SCIENCE; SECONDARY STRUCTURES; STRUCTURAL REARRANGEMENT;

MOLECULAR DYNAMICS;

BETA LACTOGLOBULIN; DECANE; OIL; WATER; ALKANE; LACTOGLOBULIN;

ADSORPTION; ARTICLE; HYDROPHOBICITY; MOLECULAR DYNAMICS; PRIORITY JOURNAL; PROTEIN INTERACTION; PROTEIN SECONDARY STRUCTURE; SURFACE AREA; SURFACE PROPERTY; AMINO ACID SEQUENCE; CHEMICAL PHENOMENA; CHEMISTRY; MOLECULAR GENETICS;

ALKANES; AMINO ACID SEQUENCE; HYDROPHOBIC AND HYDROPHILIC INTERACTIONS; LACTOGLOBULINS; MOLECULAR DYNAMICS SIMULATION; MOLECULAR SEQUENCE DATA; OILS; WATER;

EID: 84930941416     PISSN: 15257797     EISSN: 15264602     Source Type: Journal    
DOI: 10.1021/acs.biomac.5b00467     Document Type: Article

References (41)

1. Zhai, J. l.; Day, L.; Aguilar, M.-I.; Wooster, T. J. Curr. Opin. Colloid Interface Sci. 2013, 18, 257
2. Singh, H. Food Hydrocolloids 2011, 25, 1938
3. Thompson, A.; Boland, M.; Singh, H., Eds. Milk Proteins: from Expression to Food, 2 nd ed.; Academic Press, Elsevier Inc.: New York, 2009.
4. Brownlow, S.; Cabral, J. H. M.; Cooper, R.; Flower, D. R.; Yewdall, S. J.; Polikarpov, I.; North, A. C. T.; Sawyer, L. Structure 1997, 5, 481
5. Kontopidis, G.; Holt, C.; Sawyer, L. J. Mol. Biol. 2002, 318, 1043
6. Qin, B. Y.; Bewley, M. C.; Creamer, L. K.; Baker, H. M.; Baker, E. N.; Jameson, G. B. Biochemistry 1998, 37, 14014
7. Uhrínová, S.; Smith, M. H.; Jameson, G. B.; Uhrín, D.; Sawyer, L.; Barlow, P. N. Biochemistry 2000, 39, 3565
8. Kumosinski, T. F.; Timasheff, S. N. J. Am. Chem. Soc. 1966, 88, 5635
9. Mckenzie, H. A.; Sawyer, W. H. Nature 1967, 214, 1101
10. Sakurai, K.; Oobatake, M.; Goto, Y. Protein Sci. 2001, 10, 2325
11. Dalgleish, D. G. Food Hydrocolloids 2006, 20, 415
12. Kim, H. J.; Decker, E. A.; McClements, D. J. J. Agric. Food Chem. 2002, 50, 7131
13. Kim, H. J.; Decker, E. A.; McClements, D. J. Langmuir 2002, 18, 7577
14. Fang, Y.; Dalgleish, D. G. J. Colloid Interface Sci. 1997, 196, 292
15. Husband, F. A.; Garrood, M. J.; Mackie, A. R.; Burnett, G. R.; Wilde, P. J. J. Agric. Food Chem. 2001, 49, 859
16. Lee, S.-H.; Lefèvre, T.; Subirade, M.; Paquin, P. J. Agric. Food Chem. 2007, 55, 10924
17. Sakuno, M. M.; Matsumoto, S.; Kawai, S.; Taihei, K.; Matsumura, Y. Langmuir 2008, 24, 11483
18. Day, L.; Zhai, J.; Xu, M.; Jones, N. C.; Hoffmann, S. V.; Wooster, T. J. Food Hydrocolloids 2014, 34, 78
19. Zhai, J.; Miles, A. J.; Pattenden, L. K.; Lee, T.-H.; Augustin, M. A.; Wallace, B. A.; Aguilar, M.-I.; Wooster, T. J. Biomacromolecules 2010, 11, 2136
20. Zhai, J.; Wooster, T. J. Langmuir 2011, 27, 9227
21. Zhao, D.; Peng, C.; Zhou, J. Phys. Chem. Chem. Phys. 2015, 17, 840
22. Hagiwara, T.; Sakiyama, T.; Watanabe, H. Langmuir 2009, 25, 226
23. Wei, T.; Carignano, M. A.; Szleifer, I. Langmuir 2011, 27, 12074
24. Wei, T.; Carignano, M. A.; Szleifer, I. J. Phys. Chem. B 2012, 116, 10189
25. Liu, J.; Liao, C.; Zhou, J. Langmuir 2013, 29, 11366
26. Peng, C.; Liu, J.; Zhao, D.; Zhou, J. Langmuir 2014, 30, 11401
27. Euston, S. R. Food Hydrocolloids 2013, 30, 519
28. Euston, S. R.; Ur-Rehman, S.; Costello, G. Food Hydrocolloids 2007, 21, 1081
29. Cheung, D. L. Langmuir 2012, 28, 8730
30. Cheung, D. L. Adv. Chem. 2014, 2014, 12
31. Euston, S. R. Biomacromolecules 2010, 11, 2781
32. Ranatunga, R. J. K. U.; Nguyen, C. T.; Wilson, B. A.; Shinoda, W.; Nielsen, S. O. Soft Matter 2011, 7, 6942
33. Hess, B.; Kutzner, C.; van der Spoel, D.; Lindahl, E. J. Chem. Theory Comput. 2008, 4, 435
34. Darden, T.; York, D.; Pedersen, L. J. Chem. Phys. 1993, 98, 10089
35. Essmann, U.; Perera, L.; Berkowitz, M. L.; Darden, T.; Lee, H.; Pedersen, L. G. J. Chem. Phys. 1995, 103, 8577
36. Berweger, C. D.; van Gunsteren, W. F.; Müller-Plathe, F. Chem. Phys. Lett. 1995, 232, 429
37. Berendsen, H. J. C.; Postma, J. P. M.; van Gunsteren, W. F.; DiNola, A.; Haak, J. R. J. Chem. Phys. 1984, 81, 3684
38. Hess, B.; Bekker, H.; Berendsen, H. J. C.; Fraaije, J. G. E. M. J. Comput. Chem. 1997, 18, 1463
39. Kabsch, W.; Sander, C. Biopolymers 1983, 22, 2577
40. Humphrey, W.; Dalke, A.; Schulten, K. J. Mol. Graph. 1996, 14, 33
41. Touhami, A.; Alexander, M.; Kurylowicz, M.; Gram, C.; Corredig, M.; Dutcher, J. R. Soft Matter 2011, 7, 10274