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3H69

Catalytic domain of human Serine/Threonine Phosphatase 5 (PP5c) with two Zn2+ atoms complexed with endothall

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID23-1
Synchrotron siteESRF
BeamlineID23-1
Temperature [K]100
Detector technologyCCD
Collection date2008-10-25
DetectorADSC QUANTUM 315
Wavelength(s)0.98340
Spacegroup nameC 1 2 1
Unit cell lengths154.535, 41.778, 105.483
Unit cell angles90.00, 97.28, 90.00
Refinement procedure
Resolution38.320 - 2.100
R-factor0.16767
Rwork0.162
R-free0.22703
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1s95
RMSD bond length0.026
RMSD bond angle2.299
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwareMOLREP
Refinement softwareREFMAC (5.4.0067)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]40.0002.210
High resolution limit [Å]2.1002.100
Rmerge0.1140.358
Number of reflections39575
<I/σ(I)>16.33.3
Completeness [%]100.0100
Redundancy6.54.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP828910mM Tris-HCl, 40% MPD, 20% PEG MME 5000, pH 8.0, VAPOR DIFFUSION, SITTING DROP, temperature 289K

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