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2H6C

Crystal structure of reduced CprK in absence of any ligand

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRL BEAMLINE BL11-1
Synchrotron siteSSRL
BeamlineBL11-1
Temperature [K]100
Detector technologyCCD
Collection date2005-01-01
DetectorADSC QUANTUM 4
Wavelength(s)0.9
Spacegroup nameP 1 21 1
Unit cell lengths72.637, 50.030, 76.415
Unit cell angles90.00, 105.54, 90.00
Refinement procedure
Resolution29.630 - 2.900
R-factor0.2354
Rwork0.232
R-free0.30723
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2h6b
RMSD bond length0.019
RMSD bond angle2.075
Data reduction softwareCrystalClear ((MSC/RIGAKU))
Data scaling softwareSCALEPACK
Phasing softwarePHASER
Refinement softwareREFMAC (5.2.0005)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0002.970
High resolution limit [Å]2.9002.900
Rmerge0.0560.257
Number of reflections16387
<I/σ(I)>10.6
Completeness [%]99.099.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP6.52938% PEG 3350, 115mM MgCl2, 10mM DTT, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K

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