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1K3O

Crystal Structure Analysis of apo Glutathione S-Transferase

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRL BEAMLINE BL9-2
Synchrotron siteSSRL
BeamlineBL9-2
Temperature [K]100
Detector technologyCCD
Collection date2000-06-27
DetectorADSC QUANTUM 4
Spacegroup nameC 1 2 1
Unit cell lengths102.383, 96.007, 52.889
Unit cell angles90.00, 92.94, 90.00
Refinement procedure
Resolution10.000 - 1.800
R-factor0.2485
Rwork0.246
R-free0.33580
Starting model (for MR)1GSE [NO WATER OR LIGAND]
RMSD bond length0.011
RMSD bond angle0.027
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareSHELX
Refinement softwareSHELXL-97
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0001.830
High resolution limit [Å]1.8001.800
Rmerge0.0550.292
Number of reflections43692
Completeness [%]90.836.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP7.522% PEG3350, 0.1M Tris-Cl 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 100K

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