Electronic structure calculations show that the cofactor H4B can be a key factor in a proton transfer relay in nitric oxide synthase, and that 4-amino-H4B cannot fulfill this role.
I. Morao, G. Periyasamy, I. H. Hillier and J. A. Joule, Chem. Commun., 2006, 3525 DOI: 10.1039/B607426J
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