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1I2X

2.4 A STRUCTURE OF A-DUPLEX WITH BULGED ADENOSINE, SPERMIDINE FORM

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date1998-11-26
DetectorRIGAKU RAXIS IIC
Wavelength(s)1.5418
Spacegroup nameP 21 21 21
Unit cell lengths27.690, 47.710, 113.620
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution10.000 - 2.400
R-factor0.249

*

Rwork0.249
R-free0.27820
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.013

*

RMSD bond angle2.030

*

Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareCNS (1.0)
Data quality characteristics
 Overall
Low resolution limit [Å]20.000
High resolution limit [Å]2.400
Rmerge0.079

*

Number of reflections6180

*

Completeness [%]94.6

*

Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Vapor diffusion, hanging drop

*

6298spermidine, MPD. pH 6.0, VAPOR DIFFUSION, SITTING DROP at 298
Crystallization Reagents
IDcrystal IDsolution IDreagent nameconcentrationdetails
111spermidine
211MPD
312MPD
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropDNA0.72 (mM)
21reservoirsodium cacodylate20 (mM)
31reservoirspermine25 (mM)
41reservoirMPD40 (%)

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