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301 citations found for Sheldrick, G

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This article describes the Collaborative Computational Project No. 4 (CCP4). It is intended as a general literature citation for the use of the CCP4 software suite in structure determination.

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The D,L-alternating peptide H-(L-Tyr-D-Tyr)4-L-Lys-OH adopts a gramicidin A-like structure. Fragment-search strategies aiming to exploit the high-resolution data available (1.3 Å) were tested.

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In the crystal, actinomycin D intercalates between G-T wobble pairs of DNA involving the sequence d(TTAGTT); in solution, the dominant binding is between guanine and actinomycin.

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The crystal structure with seven conformers in an asymmetric unit is determined. Conformational characteristics of a flexible dipeptide are described using solid-state data and molecular modelling; predominance of folded over extended shapes is found. The presence of protecting groups does not reduce the flexibility of the molecule.

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High-resolution refinement of dimeric cytochrome c3 and detailed sequence and structural comparison with all other known c3 domains are described.

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