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2OL6

The crystal structure of OspA mutant

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 22-ID
Synchrotron siteAPS
Beamline22-ID
Temperature [K]100
Detector technologyCCD
Collection date2005-10-26
DetectorMARMOSAIC 300 mm CCD
Wavelength(s)1
Spacegroup nameP 1 21 1
Unit cell lengths32.882, 51.508, 65.639
Unit cell angles90.00, 98.56, 90.00
Refinement procedure
Resolution20.000 - 1.600
R-factor0.22005
Rwork0.218
R-free0.25877
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2g8c
RMSD bond length0.014
RMSD bond angle1.569
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareMOLREP
Refinement softwareREFMAC (5.2.0005)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.660
High resolution limit [Å]1.6001.600
Rmerge0.0480.475
Number of reflections28159
<I/σ(I)>21.52.96
Completeness [%]97.095.6
Redundancy3.73.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.129332% PEG400, 4% MPD, and 100mM Imidazole, pH 7.1, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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