Article
Comparative docking studies of CYP1b1 and its PCG-associated mutant forms.
Journal of biosciences - 1 Dec 2008
Achary Malkaram Sridhar, Nagarajam Hampapathalu Adimurthy
Abstract excerpt
Molecular docking has been used to compare and contrast the binding modes of oestradiol with the wild-type and some disease-associated mutant forms of the human CYP1b1 protein.The receptor structures used for docking were derived from molecular dynamics simulations of homology-modelled structures. Earlier studies involving molecular dynamics and principal component analysis indicated that mutations could have a...
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