Newstead Simon L, Potter Jane A, Wilson Jennifer C, Xu Guogang, Chien Chin-Hsiang, Watts Andrew G, Withers Stephen G, Taylor Garry L
Centre for Biomolecular Sciences, University of St. Andrews, St. Andrews, Fife, United Kingdom.
J Biol Chem. 2008 Apr 4;283(14):9080-8. doi: 10.1074/jbc.M710247200. Epub 2008 Jan 24.
Clostridium perfringens is a Gram-positive bacterium responsible for bacteremia, gas gangrene, and occasionally food poisoning. Its genome encodes three sialidases, nanH, nanI, and nanJ, that are involved in the removal of sialic acids from a variety of glycoconjugates and that play a role in bacterial nutrition and pathogenesis. Recent studies on trypanosomal (trans-) sialidases have suggested that catalysis in all sialidases may proceed via a covalent intermediate similar to that of other retaining glycosidases. Here we provide further evidence to support this suggestion by reporting the 0.97A resolution atomic structure of the catalytic domain of the C. perfringens NanI sialidase, and complexes with its substrate sialic acid (N-acetylneuramic acid) also to 0.97A resolution, with a transition-state analogue (2-deoxy-2,3-dehydro-N-acetylneuraminic acid) to 1.5A resolution, and with a covalent intermediate formed using a fluorinated sialic acid analogue to 1.2A resolution. Together, these structures provide high resolution snapshots along the catalytic pathway. The crystal structures suggested that NanI is able to hydrate 2-deoxy-2,3-dehydro-N-acetylneuraminic acid to N-acetylneuramic acid. This was confirmed by NMR, and a mechanism for this activity is suggested.
产气荚膜梭菌是一种革兰氏阳性细菌,可导致菌血症、气性坏疽,偶尔还会引起食物中毒。其基因组编码三种唾液酸酶,即nanH、nanI和nanJ,它们参与从多种糖缀合物中去除唾液酸,并在细菌营养和发病机制中发挥作用。最近对锥虫(跨)唾液酸酶的研究表明,所有唾液酸酶的催化可能通过与其他保留糖苷酶类似的共价中间体进行。在这里,我们通过报告产气荚膜梭菌NanI唾液酸酶催化结构域的0.97Å分辨率原子结构以及与其底物唾液酸(N-乙酰神经氨酸)的复合物(分辨率也为0.97Å)、与过渡态类似物(2-脱氧-2,3-脱氢-N-乙酰神经氨酸)的复合物(分辨率为1.5Å)以及与使用氟化唾液酸类似物形成的共价中间体的复合物(分辨率为1.2Å),提供了进一步的证据来支持这一观点。这些结构共同提供了催化途径的高分辨率快照。晶体结构表明,NanI能够将2-脱氧-2,3-脱氢-N-乙酰神经氨酸水合为N-乙酰神经氨酸。这一点通过核磁共振得到了证实,并提出了这种活性的机制。