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Department of Bioorganic Chemistry

 
 

Snapshots of the trajectory of the NOESY-distance-restrained (MORASS hybrid matrix) dynamics run showing the transition from the syn to the anti conformation for A1 in the mismatch duplex (II). Expanded stereoview of the mismatched base-pair and its neighbours in the duplex (II): (a) starting structure after minimization, (b) after the second cycle of MORASS/MD refinements and (c) fourth cycle of MORASS/MD refinements.




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