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1X1Q

Crystal structure of tryptophan synthase beta chain from Thermus thermophilus HB8

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL26B1
Synchrotron siteSPring-8
BeamlineBL26B1
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2004-04-27
DetectorRIGAKU RAXIS V
Wavelength(s)0.97920
Spacegroup nameP 21 21 2
Unit cell lengths92.187, 109.993, 74.672
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution29.600 - 2.500
R-factor0.203
Rwork0.201
R-free0.24500
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.007
RMSD bond angle1.300
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareMOLREP
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0002.590
High resolution limit [Å]2.5002.500
Rmerge0.1310.580
Number of reflections26974
<I/σ(I)>7.43.27
Completeness [%]99.599.5
Redundancy5.14.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1MICROBATCH8.52910.2M Magnesium Chloride, 0.1M Tris-HCl, 15 % w/v PEG 4000, pH 8.5, MICROBATCH, temperature 291K

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