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3E0Y

The crystal structure of a conserved domain from a protein of Geobacter sulfurreducens PCA

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 19-ID
Synchrotron siteAPS
Beamline19-ID
Temperature [K]100
Detector technologyCCD
Collection date2007-08-17
DetectorADSC QUANTUM 315
Wavelength(s)0.97945, 0.97959
Spacegroup nameP 31 2 1
Unit cell lengths59.421, 59.421, 223.175
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution42.300 - 3.100
R-factor0.21983
Rwork0.216
R-free0.29089
Structure solution methodSAD
RMSD bond length0.017
RMSD bond angle1.901
Data reduction softwareHKL-3000
Data scaling softwareHKL-3000
Phasing softwareSHELXD
Refinement softwareREFMAC (5.2.0019)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]42.3003.210
High resolution limit [Å]3.1003.100
Rmerge0.089
Number of reflections8896
<I/σ(I)>23.71.7
Completeness [%]99.597.2
Redundancy6.24.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP7.528915%(v/v) ethanol, 0.1M HEPES, 0.2M MgCl., pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 289K

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