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3A4Y

Crystal Structure of H61A mutant TTHA0252 from Thermus thermophilus HB8

Replaces:  2ZDW
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL26B2
Synchrotron siteSPring-8
BeamlineBL26B2
Temperature [K]95
Detector technologyCCD
Collection date2007-11-20
DetectorMARMOSAIC 225 mm CCD
Wavelength(s)1.282037
Spacegroup nameC 1 2 1
Unit cell lengths143.144, 146.767, 121.123
Unit cell angles90.00, 109.24, 90.00
Refinement procedure
Resolution50.000 - 2.500
Rwork0.239
R-free0.28200
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2dkf
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Refinement softwareCNS
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]50.00050.0002.590
High resolution limit [Å]2.5005.3802.500
Rmerge0.0550.0270.400
Number of reflections81538
<I/σ(I)>25.221
Completeness [%]99.999.399.8
Redundancy5.455.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP5.629350mM sodium citrate, 0.2M ammonium sulfate, 0.6M lithium sulfate, pH 5.6, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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