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2B0C

The crystal structure of the putative phosphatase from Escherichia coli

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 19-ID
Synchrotron siteAPS
Beamline19-ID
Temperature [K]100
Detector technologyCCD
Collection date2005-03-06
DetectorADSC QUANTUM 315
Wavelength(s)0.9798
Spacegroup nameP 41 21 2
Unit cell lengths62.256, 62.256, 127.038
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution50.000 - 2.000
R-factor0.20337
Rwork0.201
R-free0.25880
Structure solution methodSAD
RMSD bond length0.012
RMSD bond angle1.273
Data scaling softwareHKL-2000
Phasing softwareHKL-3000
Refinement softwareREFMAC (5.2.0005)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.070
High resolution limit [Å]2.0002.000
Rmerge0.0490.578
Number of reflections32006
<I/σ(I)>56.52.35
Completeness [%]99.293.2
Redundancy14.66.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP5.62980.05M MES, 25% PEG 5KMME, 0.2M (NH4)2SO4, 10mM MgCl2, pH 5.6, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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