NDB ID: DD0093


Title:A BIMOLECULAR PARALLEL-STRANDED HUMAN TELOMERIC QUADRUPLEX IN COMPLEX WITH A 3,6,9-TRISUBSTITUTED ACRIDINE MOLECULE BRACO19
Molecular Description:5'-D(DTpDApDGpDGpDGpDTpDTpDApDGpDGpDGp
DT)-3'
Structural Features:QUADRUPLE HELIX, bulges, OVERHANGING BASES
Nucleic Acid Sequence:
ChainsA,B:(DT) (DA) (DG) (DG) (DG) (DT) (DT) (DA) (DG) (DG) (DG) (DT)
Primary Citation:Campbell, N.H., Parkinson, G.N., Reszka, A.P., Neidle, S.
Structural basis of DNA quadruplex recognition by an acridine drug.
J.Am.Chem.Soc. , 130, pp. 6722 - 6724, 2008.
Experimental Information:X-RAY DIFFRACTION
Space Group: 4
Cell Constants:
a = 70.338b = 70.338c = 34.293(Ångstroms)
= 90.00 = 90.00 = 90.00(degrees)
Refinement:The structure was refined using the REFMAC 5.2.0019 program. The R value is 18.3 for 2852 reflections in the resolution range 35.17 to 2.50 Ångstroms .

Biological Assembly 1
Other Views
Asymmetric Unit
Crystal Packing

Biological Assemblies
Enlarge Biological Assembly 1
Enlarge Biological Assembly 2



Coordinate + Structure Data

Asymmetric Unit coordinates (pdb format, Unix compressed(.gz))

Asymmetric Unit coordinates (cif format, Unix compressed(.gz))

Biological Assembly coordinates (pdb format)12

Structure Factors (cif format)

XML | Complete with coordinates (xml format, GNU compressed(.gz))
XML | Coordinates only (xml format, GNU compressed(.gz))
XML | Header only (xml format, GNU compressed(.gz))

Derivative Data

Nucleic Acid Backbone Torsions

Links

The RCSB Protein Data Bank: 3CE5

PubMed: 18457389




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