Structure Calculation and Validation

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Introduction ==

Constraints Used in Protein NMR Structure Determination

Distance (NOE, H-bond, distance calibration, NOE averaging, stereospecific assignments


Dihedral angle (J-coupling, chemical shifts)


Orientational constraints (RDC, PRE)


Advanced Approaches to Derive Structural Information

SAXS


Computational Methods

Assignment of NOESY Peaklists and Structure Calculation




Structure Validation and Quality Assessment

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