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2DCK

A tetragonal-lattice structure of alkaliphilic XynJ from Bacillus sp. 41M-1

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL26B1
Synchrotron siteSPring-8
BeamlineBL26B1
Temperature [K]100
Detector technologyCCD
Collection date2005-10-24
DetectorRIGAKU JUPITER 210
Wavelength(s)1
Spacegroup nameP 43
Unit cell lengths116.579, 116.579, 45.909
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution50.000 - 2.100
R-factor0.16812
Rwork0.167
R-free0.19799
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2dcj
RMSD bond length0.026
RMSD bond angle1.985
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareMOLREP
Refinement softwareREFMAC (5.1.24)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]119.5202.180
High resolution limit [Å]2.1002.100
Number of reflections36572
Completeness [%]99.9100
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.527710mM sodium phosphate buffer (Na2HPO4/NaH2PO4), pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K

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