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3K9L

Allosteric modulation of H-Ras GTPase

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 22-ID
Synchrotron siteAPS
Beamline22-ID
Temperature [K]100
Detector technologyCCD
Collection date2009-03-25
DetectorMARMOSAIC 300 mm CCD
Wavelength(s)1.00
Spacegroup nameP 21 21 21
Unit cell lengths95.113, 60.632, 74.975
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution30.316 - 1.800
R-factor0.2207
Rwork0.219
R-free0.27080
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2rge
RMSD bond length0.007
RMSD bond angle1.152
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHASES
Refinement softwarePHENIX
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]31.9001.660
High resolution limit [Å]1.6001.600
Rmerge0.1000.840
Number of reflections48368
<I/σ(I)>13.11.45
Completeness [%]96.089.6
Redundancy4.12.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.5291.150.2M Calcium Acetate, 5 mM MgCl2, 10 mM DTT, 20% PEG 3350., pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 291.15K

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