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1KWG

Crystal structure of Thermus thermophilus A4 beta-galactosidase

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL40B2
Synchrotron siteSPring-8
BeamlineBL40B2
Temperature [K]100
Detector technologyCCD
Collection date2001-01-31
DetectorADSC QUANTUM 4
Wavelength(s)0.9791
Spacegroup nameP 3 2 1
Unit cell lengths97.737, 97.737, 129.370
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution19.730 - 1.600
R-factor0.167
Rwork0.167
R-free0.18400
Structure solution methodMAD
RMSD bond length0.005
RMSD bond angle22.900

*

Data reduction softwareHKL-2000
Data scaling softwareCCP4 ((SCALA))
Phasing softwareSOLVE
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]19.7301.660
High resolution limit [Å]1.6001.600
Rmerge0.0410.289
Total number of observations2467779

*

Number of reflections94451

*

<I/σ(I)>16.26.04
Completeness [%]100.0

*

99.9

*

Redundancy4.44.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.525

*

PEG 8000, sodium acetate trihydrate, sodium cacodyrate, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11reservoirsodium acetate trihydrate0.2 (M)
21reservoirPEG800020-25 (%(w/v))
31reservoirsodium cacodylate0.1 (M)pH6.5

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