NMR studies of protein-small molecule and protein-peptide interactions
Abstract
The work described in this thesis focuses on the application of various NMR techniques to the study of interactions between proteind and small molecules and proteins and peptides, incluiding the well-established classical NMR approaches, and the precently developed paramagnetic NMR methods. computational tools have been used to complement and visualized the experimental data.
Protein-ligand interactionsParamagnetic NMRComputaional modellingPseudocontact shiftLigand bindingFragment-based drug discoveryFKBPPlastocyaninEncounter complexTetralysine peptideMolecular modellingNMR spectroscopy

