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PDBsum entry 1m6r

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DNA PDB id
1m6r
Contents
DNA/RNA
Waters ×63

References listed in PDB file
Key reference
Title Crystal structure of rgd(cgcgcg): a z-Dna hexamer duplex with a 5'-(Rg) overhang.
Authors B.Pan, M.Sundaralingam.
Ref. Acta Crystallogr D Biol Crystallogr, 2003, 59, 433-437. [DOI no: 10.1107/S0907444902022655]
PubMed id 12595699
Abstract
The crystal structure of the heptamer rGd(CGCGCG) has been determined at 1.54 A resolution with R(work) and R(free) of 0.191 and 0.235, respectively. The crystal belongs to space group P2(1)2(1)2(1), with unit-cell parameters a = 17.96, b = 31.47, c = 44.73 A and two independent strands in the asymmetric unit. The chimera forms a Z-DNA hexamer duplex d(CGCGCG)(2), with the 5'-overhang rG invisible in the density. The replacement of rG in the 5' terminus of d(GCGCGCG) changes the reverse Hoogsteen G.G base pairing of the 5'-overhang dG (Pan et al., 1997). However, the replacement does not change the helix from Z-form to A-form or the water-structure motifs in the Z-DNA double-helical structure.
Figure 1.
Figure 1 (a) A-form duplex (gCGCGC)[2], (b) Z-form duplex (CGCGCG)[2].
Figure 4.
Figure 4 Hydration of the heptamer structure gCGCGCG. (a) Water structure in the minor groove. The backbones of the heptamer are shown in dark lines as zigzag chains, while hydrogen bonds are shown as dotted lines. (b) Water structure in the major groove. (c) Three different hydration patterns for the phosphate groups.
The above figures are reprinted by permission from the IUCr: Acta Crystallogr D Biol Crystallogr (2003, 59, 433-437) copyright 2003.
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