NDB ID: UP0001


Title:CRYSTAL STRUCTURE OF BACKBONE MODIFIED PNA HEXAMER
Molecular Description:PEPTIDE NUCLEIC ACID 5'-(CP1GPNTP1APNCP1
GPNLYS)-3'
Structural Features:DOUBLE HELIX, RIGH AND LEFT HANDED HELICES
Nucleic Acid Sequence:
ChainsA,B,C,D,E,F,G,H:(CP1) (GPN) (TP1) (APN) (CP1) (GPN) K
Primary Citation:Haima, G., Rasmussen, H., Schmidt, G., Jensen, D.K., Kastrup, J.S., Stafshede, P.W., Norden, B., Buchardt, O., Nielsen, P.E.
Peptide Nucleic Acids (PNA) derived from N-(N-methylaminoethyl)glycine. Synthesis, hybridization and structural properties
New J.Chem. , 23, pp. 833 - 840, 1999.
Experimental Information:X-RAY DIFFRACTION
Space Group: 21   1
Cell Constants:
a = 48.950b = 31.140c = 50.390(Ångstroms)
= 90.00 = 110.85 = 90.00(degrees)
Refinement:The structure was refined using the X-PLOR 3.851 program. The R value is 21.4 for 4049 reflections in the resolution range 6.0 to 2.2 Ångstroms with Fobs > 3.0 sigma(Fobs).

Biological Assembly 1
Other Views
Asymmetric Unit
Crystal Packing

Biological Assemblies
Enlarge Biological Assembly 1
Enlarge Biological Assembly 2
Enlarge Biological Assembly 3
Enlarge Biological Assembly 4



Coordinate + Structure Data

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

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

Biological Assembly coordinates (pdb format)1234

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: 1QPY




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