title: Selective ion-binding by protein probed with the 3D-RISM theory.
abstract: Cations (Ca2+, Na+, K+) selectively bound by human lysozyme and its mutants are probed by the 3D-RISM theory, a statistical mechanics theory of liquids.
authors.affiliation: Department of Theoretical Molecular Science, Institute for Molecular Science, Okazaki 444-8585, Japan.
authors.forename: Norio
authors.initials: N
authors.lastname: Yoshida
authors.forename: Saree
authors.initials: S
authors.lastname: Phongphanphanee
authors.forename: Yutaka
authors.initials: Y
authors.lastname: Maruyama
authors.forename: Takashi
authors.initials: T
authors.lastname: Imai
authors.forename: Fumio
authors.initials: F
authors.lastname: Hirata
mesh_terms: D002118:Calcium / Q000737:chemistry* / Q000378:metabolism*; D002413:Cations, Divalent / Q000737:chemistry / Q000378:metabolism; D006801:Humans; D008958:Models, Molecular; D009113:Muramidase / Q000737:chemistry* / Q000378:metabolism*; D011485:Protein Binding; D013816:Thermodynamics; D014867:Water / Q000737:chemistry / Q000378:metabolism
chemical_list: D002413:Cations, Divalent; D014867:Water; D009113:Muramidase; D002118:Calcium