Barrier compression enhances an enzymatic hydrogen-transfer reaction

Angewandte Chemie - International Edition

Volumn 48, Issue 8, 2009, Pages 1452-1454

  Hay, Sam ^a   Pudney, Christopher R ^a   McGrory, Tom A ^a   Pang, Jiayun ^a   Sutcliffe, Michael J ^a   Scrutton, Nigel S ^a  

^a UNIVERSITY OF MANCHESTER   (United Kingdom)

Author keywords

Enzyme catalysis; Hydrogen transfer; Molecular dynamics; Quantum chemistry; Reaction barrier

Indexed keywords

CATALYSIS; ENZYMES; HYDROGEN; HYDROSTATIC PRESSURE; MOLECULAR DYNAMICS; QUANTUM THEORY; REACTION KINETICS;

ACTIVE SITES; BINARY COMPLEXES; CHARGE-TRANSFER; CONFORMATIONAL SPACES; ENZYME CATALYSIS; FLAVIN MONONUCLEOTIDE; HYDROGEN TRANSFER; HYDROGEN-TRANSFER REACTIONS; MOLECULAR DYNAMICS SIMULATIONS; MORPHINONE REDUCTASE; QUANTUM CHEMISTRY; REACTION BARRIER;

DYNAMICS;

BACTERIAL PROTEIN; FLAVINE MONONUCLEOTIDE; HYDROGEN; MORPHINONE REDUCTASE; NICOTINAMIDE ADENINE DINUCLEOTIDE; OXIDOREDUCTASE;

ARTICLE; BIOCATALYSIS; CHEMISTRY; HYDROSTATIC PRESSURE; ION TRANSPORT; METABOLISM;

BACTERIAL PROTEINS; BIOCATALYSIS; FLAVIN MONONUCLEOTIDE; HYDROGEN; HYDROSTATIC PRESSURE; ION TRANSPORT; NAD; OXIDOREDUCTASES;

EID: 60149108648     PISSN: 14337851     EISSN: None     Source Type: Journal    
DOI: 10.1002/anie.200805502     Document Type: Article

References (37)

1. C. Lad, N. H. Williams, R. Wolfenden, Proc. Natl. Acad. Sci. USA 2003, 100, 5607.
2. W. W. Cleland, P. A. Frey, J. A. Gerlt, J. Biol. Chem. 1998, 273, 25529.
3. S. J. Benkovic, S. Hammes-Schiffer, Science 2003, 301, 1196.
4. M. Garcia-Viloca, J. Gao, M. Karplus, D. G. Truhlar, Science 2004, 303, 186.
5. S. Gladstone, K. J. Laidler, H. Eyring, The Theory of Rate Processes, McGraw-Hill, New York, 1941.
6. Z. D. Nagel, J. P. Klinman, Chem. Rev. 2006, 106, 3095.
7. D. Antoniou, J. Basner, S. Nunez, S. D. Schwartz, Chem. Rev. 2006, 106, 3170.
8. R. A. Marcus, N. Sutin, Biochim. Biophys. Acta Rev. Bioenerg. 1985, 811, 265.
9. S. Hay, C. Pudney, P. Hothi, L. O. Johannissen, L. Masgrau, J. Pang, D. Leys, M. J. Sutcliffe, N. S. Scrutton, Biochem. Soc. Trans. 2008, 36, 16.
10. D. G. Truhlar, J. L. Gao, C. Alhambra, M. Garcia-Viloca, J. Corchado, M. L. Sanchez, J. Villa, Acc. Chem. Res. 2002, 35, 341.
11. S. Hammes-Schiffer, Acc. Chem. Res. 2006, 39, 93.
12. S. Hay, M. J. Sutcliffe, N. S. Scrutton, Proc. Natl. Acad. Sci. USA 2007, 104, 507.
13. J. Basran, S. Patel, M. J. Sutcliffe, N. S. Scrutton, J. Biol. Chem. 2001, 276, 6234.
14. D. B. Northrop, J. Am. Chem. Soc. 1999, 121, 3521.
15. D. B. Northrop, Philos. Trans. R. Soc. London Ser. B 2006, 361, 1341.
16. D. B. Northrop, Biochim. Biophys. Acta Protein Struct. Mol. Enzymol. 2002, 1595, 71.
17. J. Pang, S. Hay, N. S. Scrutton, M. J. Sutcliffe, J. Am. Chem. Soc. 2008, 130, 7092.
18. D. Antoniou, S. D. Schwartz, Proc. Natl. Acad. Sci. USA 1997, 94, 12360.
19. A. M. Kuznetsov, J. Ulstrup, Can. J. Chem. 1999, 77, 1085.
20. D. Borgis, J. T. Hynes, J. Phys. Chem. 1996, 100, 1118.
21. W. J. Bruno, W. Bialek, Biophys. J. 1992, 63, 689.
22. J. Basran, R. J. Harris, M. J. Sutcliffe, N. S. Scrutton, J. Biol. Chem. 2003, 278, 43973.
23. C. R. Pudney, S. Hay, M. J. Sutcliffe, N. S. Scrutton, J. Am. Chem. Soc. 2006, 128, 14053.
24. S. Hay, C. R. Pudney, M. J. Sutcliffe, N. S. Scrutton, Angew. Chem. 2008, 120, 547;
25. Angew. Chem. Int. Ed. 2008, 47, 537.
26. S. Hay, M. J. Sutcliffe, N. S. Scrutton in Quantum Tunnelling in Enzyme Catalyzed Reactions (Eds.: R. K. Allemann, N. S. Scrutton), Royal Society of Chemistry, in press.
27. M. J. Knapp, K. Rickert, J. P. Klinman, J. Am. Chem. Soc. 2002, 124, 3865.
28. C. E. Kundrot, F. M. Richards, J. Mol. Biol. 1987, 193, 157.
29. B. Barstow, N. Ando, C. U. Kim, S. M. Gruner, Proc. Natl. Acad. Sci. USA 2008, 105, 13362.
30. D. H. Craig, P. C. E. Moody, N. C. Bruce, N. S. Scrutton, Biochemistry 1998, 37, 7598.
31. C. R. Pudney, S. Hay, J. Y. Pang, C. Costello, D. Leys, M. J. Sutcliffe, N. S. Scrutton, J. Am. Chem. Soc. 2007, 129, 13949.
32. A. H. Ewald, Trans. Faraday Soc. 1968, 64, 733.
33. P. Masson, C. Balny, Biochim. Biophys. Acta Gen. Subj. 2005, 1724, 440.
34. S. J. Benkovic, G. G. Hammes, S. Hammes-Schiffer, Biochemistry 2008, 47, 3317.
35. G. Branlant, B. Eiler, J. F. Biellmann, Anal. Biochem. 1982, 125, 264.
36. D. A. Case, T. E. Cheatham, T. Darden, H. Gohlke, R. Luo, K. M. Merz, A. Onufriev, C. Simmerling, B. Wang, R. J. Woods, J. Comput. Chem. 2005, 26, 1668.
37. Y. Duan, C. Wu, S. Chowdhury, M. C. Lee, G. M. Xiong, W. Zhang, R. Yang, P. Cieplak, R. Luo, T. Lee, J. Caldwell, J. M. Wang, P. Kollman, J. Comput. Chem. 2003, 24, 1999.