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4XOK

Observing the overall rocking motion of a protein in a crystal.

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID29
Synchrotron siteESRF
BeamlineID29
Temperature [K]100
Detector technologyPIXEL
Collection date2014-04-11
DetectorDECTRIS PILATUS 6M
Wavelength(s)0.97625
Spacegroup nameP 21 21 21
Unit cell lengths43.724, 50.364, 93.458
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution9.970 - 2.200
R-factor0.3037
Rwork0.303
R-free0.32360
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3ehv
RMSD bond length0.007
RMSD bond angle1.358
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwarePHASER
Refinement softwarePHENIX ((phenix.refine: 1.9_1692))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]46.7292.279
High resolution limit [Å]2.2002.200
Rmerge0.0830.175
Number of reflections10207
<I/σ(I)>16.04
Completeness [%]93.062
Redundancy5.64.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP729320mg/ml Ubi in 20mM NH4Ac pH4.3, 50mM HEPES pH7.0, 35% PEG 1500, 25mM Zn Acetate

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