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Structure paper

TitleMolecular basis of structure-activity relationships between salphen metal complexes and human telomeric DNA quadruplexes.
Journal, issue, pagesJ. Med. Chem., Vol. 55, Page 209-222, Year 2012
Publish dateFeb 21, 2011 (structure data deposition date)
AuthorsCampbell, N.H. / Karim, N.H. / Parkinson, G.N. / Gunaratnam, M. / Petrucci, V. / Todd, A.K. / Vilar, R. / Neidle, S.
External linksJ. Med. Chem. / PubMed:22112241
MethodsX-ray diffraction
Resolution2.4 Å
Structure data

PDB-3qsc:
The first crystal structure of a human telomeric G-quadruplex DNA bound to a metal-containing ligand (a copper complex)
Method: X-RAY DIFFRACTION / Resolution: 2.4 Å

PDB-3qsf:
The first crystal structure of a human telomeric G-quadruplex DNA bound to a metal-containing ligand (a nickel complex)
Method: X-RAY DIFFRACTION / Resolution: 2.4 Å

Chemicals

ChemComp-K:
Unknown entry

ChemComp-CUF:
[2,2'-{(4,5-difluorobenzene-1,2-diyl)bis[(nitrilo-kappaN)methylylidene]}bis{5-[2-(piperidin-1-yl)ethoxy]phenolato-kappaO}(2-)]copper (II)

ChemComp-HOH:
WATER

ChemComp-NUF:
[2,2'-{(4,5-difluorobenzene-1,2-diyl)bis[(nitrilo-kappaN)methylylidene]}bis{5-[2-(piperidin-1-yl)ethoxy]phenolato-kappa

KeywordsDNA / Parallel / telomere / quadruplex / drug / metal complex / copper complex / nickel

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