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4PHQ

ClyA CC6/264 ox (6-303)

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSLS BEAMLINE X06SA
Synchrotron siteSLS
BeamlineX06SA
Temperature [K]100
Detector technologyPIXEL
Collection date2013-02-15
DetectorPSI PILATUS 6M
Wavelength(s)1.0
Spacegroup nameC 1 2 1
Unit cell lengths176.880, 48.440, 152.430
Unit cell angles90.00, 102.33, 90.00
Refinement procedure
Resolution38.540 - 1.940
R-factor0.1731
Rwork0.172
R-free0.21370
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1qoy
RMSD bond length0.007
RMSD bond angle0.897
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwarePHASER
Refinement softwarePHENIX ((phenix.refine: 1.8.2_1309))
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]40.0002.060
High resolution limit [Å]1.9405.7601.940
Rmerge0.0760.0320.527
Rmeas0.0840.0350.579
Total number of observations511121
Number of reflections86049308213824
<I/σ(I)>14.5340.073.27
Completeness [%]91.480.990.3
Redundancy3.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP6.729319% PEG 3350, 0.1 M Tris-Acetate

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