Active-site modification of superoxide dismutase by H2O2 studied through 1H NMR of the cobalt derivatives
β Scribed by I. Bertini; C. Luchinat; M.S. Viezzoli; Y. Wang
- Book ID
- 115708049
- Publisher
- Elsevier Science
- Year
- 1989
- Tongue
- English
- Weight
- 735 KB
- Volume
- 269
- Category
- Article
- ISSN
- 0003-9861
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The molecular dynamics (MD) simulation of superoxide dismutase (SOD) in water is carried out for a total of 23 ps. The simulation system is a 26 A sphere centered at the active site of SOD, including 1602 atoms from SOD and 1761 water molecules. There is no gross deviation from the x-ray structure f