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4MOA

Crystal structure of CRY4BA-R203Q TOXIN

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsNSRRC BEAMLINE BL13B1
Synchrotron siteNSRRC
BeamlineBL13B1
Temperature [K]110
Detector technologyCCD
Collection date2008-09-12
DetectorADSC QUANTUM 1
Wavelength(s)1.0
Spacegroup nameH 3 2
Unit cell lengths184.618, 184.618, 187.359
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution30.000 - 2.000
R-factor0.22
Rwork0.216
R-free0.23690
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1w99
RMSD bond length0.006
RMSD bond angle1.330
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0002.070
High resolution limit [Å]2.0002.000
Number of reflections82325
Completeness [%]95.295
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.52910.05M ammonium acetate, 0.01M MgCl2, 10%(v/v) MPD, 0.05M Tris HCl buffer pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 291K

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