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6PV4

Structure of CpGH84A

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsCLSI BEAMLINE 08ID-1
Synchrotron siteCLSI
Beamline08ID-1
Temperature [K]100
Detector technologyCCD
Collection date2013-12-14
DetectorRAYONIX MX-300
Wavelength(s)0.97965
Spacegroup nameP 1
Unit cell lengths92.090, 92.110, 103.080
Unit cell angles95.74, 110.52, 119.71
Refinement procedure
Resolution75.450 - 2.200
R-factor0.2042
Rwork0.202
R-free0.24810
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2v5c
RMSD bond length0.005
RMSD bond angle1.198
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwarePHASER
Refinement softwareREFMAC (5.8.0253)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]78.0002.320
High resolution limit [Å]2.2002.200
Rmerge0.1670.386
Rpim0.1130.262
Number of reflections12915418702
<I/σ(I)>7.75.6
Completeness [%]98.197.3
Redundancy2.72.7
CC(1/2)0.9290.454
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP29114% PEG3350, 0.15 M CaCl2 and 20 mM octyl-beta-D-glucopyranoside

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