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3BT3

Crystal structure of a glyoxalase-related enzyme from Clostridium phytofermentans

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 31-ID
Synchrotron siteAPS
Beamline31-ID
Temperature [K]100
Detector technologyCCD
Collection date2007-11-21
DetectorADSC QUANTUM 315
Wavelength(s)0.97960
Spacegroup nameP 21 21 2
Unit cell lengths86.410, 87.100, 50.700
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution43.820 - 2.500
R-factor0.222
Rwork0.222
R-free0.27000
Structure solution methodSAD
RMSD bond length0.009
RMSD bond angle1.300
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwareSHARP
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]43.8201.780
High resolution limit [Å]1.6901.690
Rmerge0.1520.800
Number of reflections43640
<I/σ(I)>6.52.6
Completeness [%]99.9100
Redundancy13.413.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP6.52930.2M MgCl2, Bis-Tris Buffer, 25% PEG 3350, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K

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