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5A23

SdsA sulfatase triclinic form

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 19-BM
Synchrotron siteAPS
Beamline19-BM
Temperature [K]100
Detector technologyCCD
Collection date2014-03-13
DetectorADSC CCD
Spacegroup nameP 1
Unit cell lengths86.900, 86.800, 129.030
Unit cell angles107.59, 102.96, 95.59
Refinement procedure
Resolution118.770 - 2.410
R-factor0.25624
Rwork0.253
R-free0.30701
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2cg3
RMSD bond length0.018
RMSD bond angle1.894
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwarePHASER
Refinement softwareREFMAC (5.8.0107)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.460
High resolution limit [Å]2.4102.410
Rmerge0.0600.330
Number of reflections95678
<I/σ(I)>15.341.65
Completeness [%]71.859.7
Redundancy2.971.94
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1710% PEG 4000, 10% ISOPROPANOL, 100MM LICL, 100 MM SODIUM CITRATE PH 6.

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