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Conformational energy calculations of enzyme-substrate complexes of lysozyme. I. Energy minimization of monosaccharide and oligosaccharide inhibitors and substrates of lysozyme

✍ Scribed by Matthew R. Pincus; Antony W. Burgess; Harold A. Scheraga

Publisher: Wiley (John Wiley & Sons)
Year: 1977
Tongue: English
Weight: 26 KB
Volume: 16
Category: Article
ISSN: 0006-3525
DOI: 10.1002/bip.1977.360160220

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✦ Synopsis

On p. 2515, the following line of copy was inadvertently dropped from between the 15th and 16th lines:

In all, 72 possible conformations were considered. The energy minima

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✍ Timothy R. Dafforn; Ian G. Badcoe; Richard B. Sessions; Ayman S. El Hawrani; J. 📂 Article 📅 1997 🏛 John Wiley and Sons 🌐 English ⚖ 204 KB

Current methods for reengineering enzyme substrate specificities rely heavily on the use of static x-ray crystallographic models. In this article we detail the use of a molecular mechanics approach for suggesting regions of Bacillus stearothermophilus Llactate dehydrogenase (EC 1.1.1.27) involved in