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3BSE

Crystal structure analysis of a 16-base-pair B-DNA

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsCHESS BEAMLINE A1
Synchrotron siteCHESS
BeamlineA1
Temperature [K]100
Detector technologyCCD
Collection date2005-04-23
DetectorADSC QUANTUM 210
Wavelength(s)0.99
Spacegroup nameH 3
Unit cell lengths38.740, 38.740, 161.327
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution8.000 - 1.600
R-factor0.221
R-free0.27400
Structure solution methodSAD
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareSOLVE
Refinement softwareCNS
Data quality characteristics
 Overall
Low resolution limit [Å]8.000
High resolution limit [Å]1.600
Number of reflections11667
Completeness [%]98.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8277Hanging drop: 0.25mM DNA duplex, 5mM CaCl2, 0.2M KCl, 5% PEG10K, 5% MPD and 50mM Tris-HCl pH 8.0 Reservoir: 10% PEG10K, 10% MPD and 100mM Bicine pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 277K
Crystallization Reagents
IDcrystal IDsolution IDreagent nameconcentrationdetails
111CaCl2
211KCl
311PEG10K
411MPD
511Tris-HCl
612PEG10K
712MPD
812Bicine

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