Polymorphism at 129 dictates metastable conformations of the human prion protein N-terminal β-sheet† †Electronic supplementary information (ESI) available. See DOI: 10.1039/c6sc03275c Click here for additional data file.

Polymorphism at 129 dictates metastable conformations of the human prion protein N-terminal β-sheet.

We study the thermodynamic stability of the native state of the human prion protein using a new free-energy method, replica-exchange on-the-fly parameterization. This method is designed to overcome hidden-variable sampling limitations to yield nearly error-free free-energy profiles along a conformational coordinate. We confirm that all four (M129V, D178N) polymorphs have a ground-state conforma...

Semisynthetic prion protein (PrP) variants carrying glycan mimics at position 181 and 197 do not form fibrils† †Electronic supplementary information (ESI) available. See DOI: 10.1039/c7sc02719b Click here for additional data file.

Remote stereoselective deconjugation of α,β-unsaturated esters by simple amidation reactions† †Electronic supplementary information (ESI) available. CCDC 1034974, 1034976–1034978. For ESI and crystallographic data in CIF or other electronic format see DOI: 10.1039/c5sc01118c Click here for additional data file. Click here for additional data file.

Highly bent crystals formed by restrained π-stacked columns connected via alkylene linkers with variable conformations† †Electronic supplementary information (ESI) available. CCDC 1013992–1013996. For ESI and crystallographic data in CIF or other electronic format see DOI: 10.1039/c4sc03849e Click here for additional data file. Click here for additional data file.

Department of Chemistry, Graduate School Bio-Molecules (WPI-ITbM), Nagoya Univer Japan. E-mail: [email protected]. Materials Characterization Support Unit, R (CEMS), 2-1 Hirosawa, Wako, Saitama 351† Electronic supplementary information ( For ESI and crystallographic data in CI 10.1039/c4sc03849e ‡ Current address: Department of Appl Kaohsiung, 700 Kaohsiung University Roa Cite this: Chem....

Transformable H-bonds and conformation in compressed glucose† †Electronic supplementary information (ESI) available: Detailed experimental data; detailed structural data. CCDC 1033994–1034008. For ESI and crystallographic data in CIF or other electronic format see DOI: 10.1039/c4sc03588g Click here for additional data file. Click here for additional data file. Click here for additional data file. Click here for additional data file.