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2E24

crystal structure of a mutant (R612A) of xanthan lyase

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL38B1
Synchrotron siteSPring-8
BeamlineBL38B1
Temperature [K]100
Detector technologyCCD
DetectorRIGAKU JUPITER 210
Wavelength(s)1
Spacegroup nameP 1 21 1
Unit cell lengths53.807, 90.230, 78.098
Unit cell angles90.00, 97.56, 90.00
Refinement procedure
Resolution46.900 - 2.150
R-factor0.175
Rwork0.175
R-free0.21700
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1x1h
RMSD bond length0.005
RMSD bond angle1.200
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareCNS
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.230
High resolution limit [Å]2.1502.150
Rmerge0.1130.324
Number of reflections39353
Completeness [%]97.377.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP929322% PEG 4000, 0.2M ammonium formate, 0.1M Sodium Bicine, pH 9, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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