NDB ID: DD0063


Title:CRYSTAL STRUCTURE OF THE MG2+-(CHROMOMYCIN A3)2-D(TTGGCCAA)2 COMPLEX REVEALS GGCC BINDING SPECIFICITY OF THE DRUG DIMER CHELATED BY METAL ION
Molecular Description:5'-D(TpTpGpGpCpCpApA)-3'
Structural Features:A DOUBLE HELIX
Nucleic Acid Sequence:
ChainsA,B,C,D:(DT) (DT) (DG) (DG) (DC) (DC) (DA) (DA)
Primary Citation:Hou, M.H., Robinson, H., Gao, Y.G., Wang, A.H.-J.
Crystal structure of the [Mg2+-(chromomycin A3)2]-d(TTGGCCAA)2 complex reveals GGCC binding specificity of the drug dimer chelated by a metal ion
Nucleic Acids Res. , 32, pp. 2214 - 2222, 2004.
Experimental Information:X-RAY DIFFRACTION
Space Group: 65   2
Cell Constants:
a = 42.23b = 42.23c = 246.11(Ångstroms)
= 90. = 90. = 120.(degrees)
Refinement:The structure was refined using the CNS program. The R value is 23.5 for 7815 reflections in the resolution range 50. to 2.0 Ångstroms with Fobs > 10. sigma(Fobs).

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

Base Pair Parameters

Base Pair Step Parameters

Hydrogen Bonding Classification

Links

The RCSB Protein Data Bank: 1VAQ

PubMed: 15107489




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