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2OY1

The crystal structure of OspA mutant

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 23-ID-B
Synchrotron siteAPS
Beamline23-ID-B
Temperature [K]100
Detector technologyCCD
Collection date2007-02-16
DetectorMARMOSAIC 300 mm CCD
Wavelength(s)1.0332
Spacegroup nameP 1 21 1
Unit cell lengths36.046, 56.005, 66.204
Unit cell angles90.00, 97.09, 90.00
Refinement procedure
Resolution20.000 - 1.860
R-factor0.20764
Rwork0.206
R-free0.23635
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2g8c
RMSD bond length0.023
RMSD bond angle1.971
Data reduction softwareHKL-3000
Data scaling softwareHKL-3000
Phasing softwareMOLREP
Refinement softwareREFMAC (5.2.0005)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.920
High resolution limit [Å]1.8501.850
Rmerge0.0840.084
Number of reflections22098
<I/σ(I)>13.93.61
Completeness [%]99.8100
Redundancy3.63.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP829326% PEG3350, 0.1M Imidazole, pH 8, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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