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3KDY

X-ray crystal structure of tyrosine aminomutase mutant construct

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsNSLS BEAMLINE X25
Synchrotron siteNSLS
BeamlineX25
Temperature [K]100
Detector technologyCCD
Collection date2007-05-03
DetectorADSC QUANTUM 4
Wavelength(s)1.0000
Spacegroup nameP 21 21 2
Unit cell lengths92.583, 145.881, 74.908
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution43.100 - 2.200
R-factor0.239
Rwork0.239
R-free0.26500
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2ohy
RMSD bond length0.005
RMSD bond angle0.800
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.280
High resolution limit [Å]2.2002.200
Rmerge0.122
Number of reflections47693
<I/σ(I)>111.8
Completeness [%]95.287.1
Redundancy4.64
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP92774.6 M Sodium formate, 100 mM Trimethylamine N-oxide, pH 9.0, VAPOR DIFFUSION, HANGING DROP, temperature 277K

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