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2WQL

CRYSTAL STRUCTURE OF THE MAJOR CARROT ALLERGEN DAU C 1

Replaces:  2VJG
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSLS BEAMLINE X06SA
Synchrotron siteSLS
BeamlineX06SA
Temperature [K]100
Detector technologyCCD
Collection date2005-12-27
DetectorMARRESEARCH
Spacegroup nameP 41 3 2
Unit cell lengths189.948, 189.948, 189.948
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution30.000 - 2.700
R-factor0.22228
Rwork0.221
R-free0.23734
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2bk0
RMSD bond length0.011
RMSD bond angle1.217
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwareMOLREP
Refinement softwareREFMAC (5.5.0072)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]77.6002.850
High resolution limit [Å]2.7002.700
Rmerge0.0900.400
Number of reflections31520
<I/σ(I)>133.1
Completeness [%]96.896.5
Redundancy3.63.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
15.42% PEG 400, 100MM NA CITRATE PH 5.4, 2M AMMONIUM SULFATE

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