473d

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|PDB= 473d |SIZE=350|CAPTION= <scene name='initialview01'>473d</scene>, resolution 1.58&Aring;
|PDB= 473d |SIZE=350|CAPTION= <scene name='initialview01'>473d</scene>, resolution 1.58&Aring;
|SITE=
|SITE=
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|LIGAND= <scene name='pdbligand=NT:NETROPSIN'>NT</scene> and <scene name='pdbligand=NI:NICKEL (II) ION'>NI</scene>
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|LIGAND= <scene name='pdbligand=DA:2&#39;-DEOXYADENOSINE-5&#39;-MONOPHOSPHATE'>DA</scene>, <scene name='pdbligand=DC:2&#39;-DEOXYCYTIDINE-5&#39;-MONOPHOSPHATE'>DC</scene>, <scene name='pdbligand=DG:2&#39;-DEOXYGUANOSINE-5&#39;-MONOPHOSPHATE'>DG</scene>, <scene name='pdbligand=DT:THYMIDINE-5&#39;-MONOPHOSPHATE'>DT</scene>, <scene name='pdbligand=NI:NICKEL+(II)+ION'>NI</scene>, <scene name='pdbligand=NT:NETROPSIN'>NT</scene>
|ACTIVITY=
|ACTIVITY=
|GENE=
|GENE=
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|DOMAIN=
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|RELATEDENTRY=
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|RESOURCES=<span class='plainlinks'>[http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=473d FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=473d OCA], [http://www.ebi.ac.uk/pdbsum/473d PDBsum], [http://www.rcsb.org/pdb/explore.do?structureId=473d RCSB]</span>
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}}
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[[Category: Malinina, L.]]
[[Category: Malinina, L.]]
[[Category: Subirana, J A.]]
[[Category: Subirana, J A.]]
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[[Category: NI]]
 
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[[Category: NT]]
 
[[Category: minor groove binding]]
[[Category: minor groove binding]]
[[Category: netropsin/guanine stacking]]
[[Category: netropsin/guanine stacking]]
[[Category: ni2+/guanine interaction]]
[[Category: ni2+/guanine interaction]]
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Thu Mar 20 19:08:40 2008''
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Mon Mar 31 05:37:38 2008''

Revision as of 02:37, 31 March 2008


PDB ID 473d

Drag the structure with the mouse to rotate
, resolution 1.58Å
Ligands: , , , , ,
Resources: FirstGlance, OCA, PDBsum, RCSB
Coordinates: save as pdb, mmCIF, xml



NI2+/GUANINE INTERACTIONS AND NETROPSIN/GUANINE STACKING IN D(CGTATATACG)2


Overview

We present the structure of the decanucleotide d(CGTATATACG) determined by single crystal X-ray diffraction at 1.58 A resolution. A netropsin drug is found in the minor groove with guanine stacked on a pyrrole ring of the drug, a feature described here for the first time. The stacked guanine is an extra-helical base coming from the end of a neighbour oligonucleotide. This observation may open the way to the development of minor groove binding drugs with a higher sequence selectivity. The oligonucleotide is in the B-conformation, but the terminal base-pairs are disrupted: the cytosine residues are disordered while the guanine residues penetrate into the minor groove of neighbouring duplexes. Four hydrated Ni ions with octahedral co-ordination are found associated with the N7 atoms of each guanine. The high affinity of these ions with guanine suggests that they may be used as probes for specific guanine residues.

About this Structure

473D is a Protein complex structure of sequences from [1]. Full crystallographic information is available from OCA.

Reference

Stacking interaction of guanine with netropsin in the minor groove of d(CGTATATACG)2., Abrescia NG, Malinina L, Subirana JA, J Mol Biol. 1999 Dec 3;294(3):657-66. PMID:10610787

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