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5VPK

CRYSTAL STRUCTURE OF MITE ALLERGEN DER F 1

Replaces:  3D6S
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 19-ID
Synchrotron siteAPS
Beamline19-ID
Temperature [K]100
Detector technologyCCD
Collection date2008-02-24
DetectorADSC QUANTUM 315
Wavelength(s)0.9794
Spacegroup nameP 41
Unit cell lengths91.159, 91.159, 77.743
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution36.100 - 2.000
R-factor0.18099
Rwork0.180
R-free0.21008
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2as8
RMSD bond length0.012
RMSD bond angle1.421
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareHKL-3000
Refinement softwareREFMAC (5.8.0158)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.030
High resolution limit [Å]2.0002.000
Rmerge0.0880.591
Number of reflections40623
<I/σ(I)>34.24.2
Completeness [%]94.1100
Redundancy6.56.7
CC(1/2)0.860
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION10.5293PROTEIN SOLUTION: 0.5M L-ARGININE, 0.12M LI SULFATE, 0.004M EDTA, 0.1M CAPS, PH 10.5, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 293K, PH 10.50

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