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4UW2

Crystal structure of Csm1 in T.onnurineus

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsPAL/PLS BEAMLINE 7A (6B, 6C1)
Synchrotron sitePAL/PLS
Beamline7A (6B, 6C1)
Temperature [K]95
Detector technologyCCD
Collection date2013-07-10
DetectorADSC CCD
Spacegroup nameC 1 2 1
Unit cell lengths57.894, 158.292, 299.275
Unit cell angles90.00, 89.97, 90.00
Refinement procedure
Resolution30.657 - 2.632
R-factor0.2061
Rwork0.203
R-free0.26090
Structure solution methodSAD
Starting model (for MR)NONE
RMSD bond length0.002
RMSD bond angle0.608
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHENIX
Refinement softwarePHENIX ((PHENIX.REFINE))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.680
High resolution limit [Å]2.6302.630
Rmerge0.0700.070
Number of reflections78224
<I/σ(I)>40.844.67
Completeness [%]98.298.5
Redundancy6.85.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
170.2 M AMMONIUM CITRATE PH 7.0, 20% PEG3350

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