Thiamin diphosphate ThDP is an essential cofactor for a number of Ž . enzymes, especially of pyruvate decarboxylase PDC which catalyzes the decarboxylation of ␣-keto acids. Recently, the crystal structure of PDC-bound ThDP has been determined. Ž . Based on these X-ray data molecular dynamics MD simu
✦ LIBER ✦
Molecular Dynamics Simulations on the Coenzyme Thiamin Diphosphate in Apoenzyme Environment
✍ Scribed by Anne Fircks; Stefan Naumann; Rudolf Friedemann; Stephan König
- Book ID
- 106240876
- Publisher
- Springer-Verlag
- Year
- 1996
- Tongue
- English
- Weight
- 444 KB
- Volume
- 2
- Category
- Article
- ISSN
- 1610-2940
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## Abstract Combinatorial bio‐techniques have demonstrated that proteins can be good and even selective binders for several inorganic surfaces, including metals. However, the understanding of the basic physical mechanisms that govern such interactions did not keep up with the success in these exper