Ontology highlight
ABSTRACT:
SUBMITTER: Lee J
PROVIDER: S-EPMC1300763 | biostudies-other | 2000 Apr
REPOSITORIES: biostudies-other
Biophysical journal 20000401 4
We have investigated the response of a protein structure to cavity-creating mutations by molecular dynamics (MD) simulations for the wild-type and the five mutants of phage T4 lysozyme. Essential dynamics (ED) analysis and the methods for calculating different components of local interaction energies are used to examine the structural and energetic characteristics associated with the mutations. In agreement with the x-ray results, it is found that the structural changes due to the replacements o ...[more]