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264d

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(New page: 200px<br /><applet load="264d" size="350" color="white" frame="true" align="right" spinBox="true" caption="264d, resolution 2.440&Aring;" /> '''THREE-DIMENSIONAL C...)
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==Overview==
==Overview==
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The molecular structure of the DNA A-tract dodecamer d(CGCAAATTTGCG), complexed with the drug Hoechst 33258 has been determined by X-ray, diffraction analysis. The Hoechst molecule binds in the DNA minor groove, covering the sequence AATTT of the central A-tract, with the piperazine, group close to one of the GC regions. The drug molecule makes two, three-centered hydrogen bonds from the nitrogen atoms of the benzimidazole, rings to the N3 and O2 atoms of the DNA bases. Although a high propeller, twist is observed in the A-tract, only one unsymmetrical three-centered, hydrogen bond is present in the DNA major groove. The structure is, compared with other minor-groove-binding drug complexes and the influence, of these drugs on DNA A-tracts is discussed.
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The molecular structure of the DNA A-tract dodecamer d(CGCAAATTTGCG) complexed with the drug Hoechst 33258 has been determined by X-ray diffraction analysis. The Hoechst molecule binds in the DNA minor groove covering the sequence AATTT of the central A-tract, with the piperazine group close to one of the GC regions. The drug molecule makes two three-centered hydrogen bonds from the nitrogen atoms of the benzimidazole rings to the N3 and O2 atoms of the DNA bases. Although a high propeller twist is observed in the A-tract, only one unsymmetrical three-centered hydrogen bond is present in the DNA major groove. The structure is compared with other minor-groove-binding drug complexes and the influence of these drugs on DNA A-tracts is discussed.
==About this Structure==
==About this Structure==
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[[Category: Protein complex]]
[[Category: Protein complex]]
[[Category: Aymami, J.]]
[[Category: Aymami, J.]]
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[[Category: Boom, J.H.Van.]]
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[[Category: Boom, J H.Van.]]
[[Category: Coll, M.]]
[[Category: Coll, M.]]
[[Category: Eritja, R.]]
[[Category: Eritja, R.]]
[[Category: Garcia-Saez, I.]]
[[Category: Garcia-Saez, I.]]
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[[Category: Marel, G.A.Van.Der.]]
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[[Category: Marel, G A.Van Der.]]
[[Category: Rich, A.]]
[[Category: Rich, A.]]
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[[Category: Vega, M.C.]]
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[[Category: Vega, M C.]]
[[Category: HT]]
[[Category: HT]]
[[Category: b-dna]]
[[Category: b-dna]]
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[[Category: double helix]]
[[Category: double helix]]
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Tue Jan 29 17:49:48 2008''
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Thu Feb 21 16:21:58 2008''

Revision as of 14:22, 21 February 2008


264d, resolution 2.440Å

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THREE-DIMENSIONAL CRYSTAL STRUCTURE OF THE A-TRACT DNA DODECAMER D(CGCAAATTTGCG) COMPLEXED WITH THE MINOR-GROOVE-BINDING DRUG HOECHST 33258

Overview

The molecular structure of the DNA A-tract dodecamer d(CGCAAATTTGCG) complexed with the drug Hoechst 33258 has been determined by X-ray diffraction analysis. The Hoechst molecule binds in the DNA minor groove covering the sequence AATTT of the central A-tract, with the piperazine group close to one of the GC regions. The drug molecule makes two three-centered hydrogen bonds from the nitrogen atoms of the benzimidazole rings to the N3 and O2 atoms of the DNA bases. Although a high propeller twist is observed in the A-tract, only one unsymmetrical three-centered hydrogen bond is present in the DNA major groove. The structure is compared with other minor-groove-binding drug complexes and the influence of these drugs on DNA A-tracts is discussed.

About this Structure

264D is a Protein complex structure of sequences from [1] with as ligand. Full crystallographic information is available from OCA.

Reference

Three-dimensional crystal structure of the A-tract DNA dodecamer d(CGCAAATTTGCG) complexed with the minor-groove-binding drug Hoechst 33258., Vega MC, Garcia Saez I, Aymami J, Eritja R, Van der Marel GA, Van Boom JH, Rich A, Coll M, Eur J Biochem. 1994 Jun 15;222(3):721-6. PMID:7517864

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