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Abbreviations: CPI, cyclopropa[c]pyrrolo[3,2-e]indol-4(5H)-one; CPI-I, 2-(Indol-2-ylcarbonyl)-1,2,8,8a-tetrahydro-7-methylcyclopropa[c]-pyrrolo[3,2-e] indol-4(5H)-one (U72779); 5- and 8-CPI-I, CPI-I covalently attached at either 5A or 8A, respectively, on a 10-mer sequence; NMR, nuclear magnetic resonance; NOE, nuclear Overhauser effect; DQF-COSY, double-quantum-filtered correlated spectroscopy; PE-COSY, primitive exclusive correlated spectroscopy; ppm, parts per million; FID, free-induction decay; PSEUROT, computer-assisted pseudorotational analysis of five-membered rings by means of vicinal proton spin - spin coupling constants; DEAE, (diethylamino)ethyl; DMF, dimethylformamide; rMD, restrained molecular dynamics; PAGE, polyacrylamide gel electrophoresis; ID, one-dimensional; 2D, two-dimensional; RMSD, root mean square difference.
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