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5XX6

Hetero-micro-seeding: Crystal structure of BPTI-[5,55]C14GA38I variant using micro-seeds from -C14GA38G variant

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsPHOTON FACTORY BEAMLINE AR-NE3A
Synchrotron sitePhoton Factory
BeamlineAR-NE3A
Temperature [K]101
Detector technologyCCD
Collection date2010-11-26
DetectorAGILENT EOS CCD
Wavelength(s)1.0
Spacegroup nameP 1 21 1
Unit cell lengths25.163, 41.284, 53.928
Unit cell angles90.00, 99.32, 90.00
Refinement procedure
Resolution53.220 - 1.310
R-factor0.18063
Rwork0.179
R-free0.20951
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2zvx
RMSD bond length0.028
RMSD bond angle2.620
Data reduction softwareDENZO
Data scaling softwareSCALA
Refinement softwareREFMAC (5.8.0158)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]53.2201.360
High resolution limit [Å]1.3101.310
Rmerge0.289
Number of reflections26484
<I/σ(I)>4.344.34
Completeness [%]98.098
Redundancy3.63.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8.529320-30% PEG4000; 0.2M Lithium Sulfate; 0.1M Tris-HCl pH8.5

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