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1WCG

Aphid myrosinase

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID14-2
Synchrotron siteESRF
BeamlineID14-2
Temperature [K]100
Detector technologyCCD
Collection date2002-11-03
DetectorADSC CCD
Spacegroup nameP 1 21 1
Unit cell lengths73.853, 67.365, 97.301
Unit cell angles90.00, 93.70, 90.00
Refinement procedure
Resolution19.650 - 1.100
R-factor0.133
Rwork0.132
R-free0.14600
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1cbg
RMSD bond length0.006
RMSD bond angle1.172
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwareMOLREP
Refinement softwareREFMAC (5.2.0003)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]19.6501.130
High resolution limit [Å]1.1001.100
Rmerge0.0600.190
Number of reflections384672
<I/σ(I)>3.73.6
Completeness [%]87.042.4
Redundancy3.42.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8APHID MYROSINASE IN 20 MM TRIS PH 8.0, 150 MM NACL, 10 MM MGCL2 AND 5MM DDT AT 10 MG/ML. CRYSTALS WERE GROWN IN HANGING DROPS WITH PRECIPITANT 0.2M SODIUM FORMATE, 20% PEG3350 MIXED TO THE PROTEIN AT A RATIO OF 1:1.

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