Co 2+/Co + redox tuning in methyltransferases induced by a conformational change at the axial ligand

Inorganic Chemistry

Volumn 51, Issue 10, 2012, Pages 5533-5538

  Kumar, Manoj ^a   Kumar, Neeraj ^a   Hirao, Hajime ^b   Kozlowski, Pawel M ^a  

^a UNIVERSITY OF LOUISVILLE   (United States)

^b Nanyang Technological University   (Singapore)

Author keywords

[No Author keywords available]

Indexed keywords

CATION; COBALT; CYANOCOBALAMIN; LIGAND; METHYLTRANSFERASE;

ARTICLE; CATALYSIS; CHEMICAL STRUCTURE; CHEMISTRY; OXIDATION REDUCTION REACTION; QUANTUM THEORY; THERMODYNAMICS;

CATALYSIS; CATIONS; COBALT; LIGANDS; METHYLTRANSFERASES; MODELS, MOLECULAR; OXIDATION-REDUCTION; QUANTUM THEORY; THERMODYNAMICS; VITAMIN B 12;

EID: 84861302831     PISSN: 00201669     EISSN: None     Source Type: Journal    
DOI: 10.1021/ic201970k     Document Type: Article

References (45)

1. Golding, C. W.; Postigo, D.; Matthews, R. G. Biochemistry 1997, 36, 8082-8091
2. Hagemeier, C. H.; Kruer, M.; Thauer, R. K.; Warkentin, E.; Ermler, U. Proc. Natl. Acad. Sci. U.S.A. 2006, 103, 18917-18922
3. Ragsdale, S. W.; Wood, H. G. J. Biol. Chem. 1985, 260, 3970-3977
4. Matthews, R. G.; Koutmos, M.; Datta, S. Curr. Opin. Struct. Biol. 2008, 18, 658-666
5. Escalante-Semerena, J. C.; Suh, S.-J.; Roth, J. R. J. Bactriol. 1990, 172, 273-280
6. Stich, T. A.; Buan, N. R.; Escalante-Semerena, J. C.; Brunold, T. C. J. Am. Chem. Soc. 2005, 127, 8710-8719
7. Maurice, M. St.; Mera, P. E.; Taranto, M. P.; Sesma, F.; Escalante-Semerena, J. C.; Rayment, I. J. Biol. Chem. 2007, 282, 2596-2605
8. Buan, N. R.; Suh, S-. J.; Escalante-Semerena, J. C. J. Bactriol. 2004, 186, 5708-5716
9. Lexa, D.; Savéant, J. M. Acc. Chem. Res. 1983, 16, 235-243
10. Vetter, H., Jr.; Knappe, J. Z. Physiol. Chem. 1971, 352, 433-446
11. Wolthers, K. R.; Scrutton, N. S. J. FEBS 2009, 276, 1942-1951
12. Koutmos, M.; Datta, S.; Pattridge, K. A.; Smith, J. L.; Matthews, R. G. Proc. Natl. Acad. Sci. U.S.A. 2009, 106, 18527-18532
13. Liptak, M. D.; Brunold, T. C. J. Am. Chem. Soc. 2006, 128, 9144-9156
14. Liptak, M. D.; Datta, S.; Matthews, R. G.; Brunold, T. C. J. Am. Chem. Soc. 2008, 130, 16374-16381
15. Stich, T. A.; Seravalli, J.; Venkateshrao, S.; Spiro, T. G.; Ragsdale, S. W.; Brunold, T. C. J. Am. Chem. Soc. 2006, 128, 5010-5020
16. Shi, S.; Daniels, L. M.; Espenson, J. H. Inorg. Chem. 1991, 30, 3407-3410
17. Hu, X. L.; Brunschwig, B. S.; Peters, J. C. J. Am. Chem. Soc. 2007, 129, 8988-8998
18. Voloshin, Y. Z.; Varzatskii, O. A.; Vorontsov, I. I.; Antipin, M. Y. Angew. Chem., Int. Ed. 2005, 44, 3400-3402
19. Kozelka, J.; Bergës, J.; Attias, R.; Fraitag, J. Angew. Chem., Int. Ed. 2000, 39, 198-201
20. Rizzato, S.; Bergës, J.; Mason, S. A.; Albinati, A.; Kozelka, J. Angew. Chem., Int. Ed. 2010, 49, 7440-7443
21. Kumar, M.; Kozlowski, P. M. Angew. Chem., Int. Ed. 2011, 50, 8705-8707
22. Braga, D.; Grepioni, F.; Tedesco, E.; Biradha, K.; Desiraju, G. R. Organometallics 1997, 16, 1846-1845
23. Jensen, K. P. J. Phys. Chem. B 2005, 109, 10505-10512
24. Kumar, N.; Prieto, M. A.; Rovira, C.; Lodowski, P.; Jaworska, M.; Kozlowski, P. M. J. Chem. Theory Comput. 2011, 7, 1541-1551
25. Becke, A. D. J. Chem. Phys. 1986, 84, 4524-4529
26. Perdew, J. P. Phys. Rev. B 1986, 33, 8822-8824
27. Becke, A. D. J. Chem. Phys. 1997, 107, 8554-8560
28. Hamprecht, F. A.; Cohen, A. J.; Tozer, D. J.; Handy, N. C. J. Chem. Phys. 1998, 109, 6264-6271
29. Schmider, H. L.; Becke, A. D. J. Chem. Phys. 1998, 108, 9624-9631
30. Grimme, S. J. J. Comput. Chem. 2006, 27, 1787-1799
31. Chai, J. -D.; Head-Gordon, M. J. Chem. Phys. 2008, 128, 084106
32. Chai, J. -D.; Head-Gordon, M. Phys. Chem. Chem. Phys. 2008, 10, 6615-6622
33. Frisch, M. J.; Gaussian 09, revision C.02; Gaussian, Inc.: Wallingford, CT, 2009.
34. Bader, R. F. W. Atoms in Molecules: A Quantum Theory; Oxford University Press: New York, 1990.
35. Kristyan, S.; Pulay, P. Chem. Phys. Lett. 1994, 229, 175-180
36. Kräutler, B.; Keller, W.; Kratky, C. J. Am. Chem. Soc. 1989, 111, 8938-8940
37. Li, H.; Robertson, A. D.; Jensen, J. H. Proteins 2005, 61, 704-721
38. Bas, D. C.; Rogers, D. M.; Jensen, J. H. Proteins 2008, 73, 765-783
39. Besler, B. H.; Merz, K. M.; Kollman, P. A. J. Comput. Chem. 1990, 11, 431-439
40. Popelier, P. Atoms in Molecules: An Introduction; Pearson Education: Harlow, England, 2000.
41. Rozas, I.; Alkorta, I.; Elguero, J. J. Am. Chem. Soc. 2000, 122, 11154-11161
42. Brookharta, M.; Green, M. L. H.; Parkin, G. Proc. Natl. Acad. Sci. U.S.A. 2007, 104, 6908-6914
43. Keum, C.; Kim, C.; Kim, C.; Kwak, H.; Moonhee Kwon, M.; Namgung, H. Bull. Korean Chem. Soc. 1992, 13, 695-699
44. Thakur, T. S.; Desiraju, G. R. Chem. Commun. 2006, 553-554
45. Baidina, I. A.; Podberezskaya, N. V.; Krylova, L. F.; Borisov, S. V. J. Struct. Chem. 1981, 22, 463-465