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3G7G

Crystal structure of the protein with unknown function from Clostridium acetobutylicum ATCC 824

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 19-ID
Synchrotron siteAPS
Beamline19-ID
Temperature [K]100
Detector technologyCCD
Collection date2007-12-18
DetectorADSC QUANTUM 315
Wavelength(s)0.9794
Spacegroup nameP 1 21 1
Unit cell lengths67.048, 166.841, 66.974
Unit cell angles90.00, 119.06, 90.00
Refinement procedure
Resolution58.620 - 1.990
R-factor0.19649
Rwork0.193
R-free0.25370
Structure solution methodSAD
RMSD bond length0.017
RMSD bond angle1.648
Data reduction softwareHKL-3000
Data scaling softwareHKL-3000
Phasing softwareHKL-3000
Refinement softwareREFMAC (5.2.0019)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]58.6202.050
High resolution limit [Å]1.9901.990
Rmerge0.1030.439
Number of reflections81173
<I/σ(I)>12.631.47
Completeness [%]97.984.82
Redundancy4.33.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP6.528920% PEG 3350, 0.1M Bis-tris, 0.2M NaCl, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 289K

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