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2I33

The structure of the Class C acid phosphatase from Bacillus anthracis

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsALS BEAMLINE 4.2.2
Synchrotron siteALS
Beamline4.2.2
Temperature [K]140
Detector technologyCCD
Collection date2005-10-14
DetectorNOIR-1
Wavelength(s)1.2037
Spacegroup nameP 21 21 21
Unit cell lengths52.231, 89.909, 104.238
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution42.120 - 1.570
R-factor0.175
Rwork0.173
R-free0.20700
Structure solution methodSAD
RMSD bond length0.011
RMSD bond angle1.318
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareSOLVE
Refinement softwareREFMAC
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]42.1201.660
High resolution limit [Å]1.5701.570
Number of reflections66821
Completeness [%]99.999.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP72980.1 M HEPES pH 7.0 30% v/v Jeffamine ED-2001 reagent, VAPOR DIFFUSION, SITTING DROP, temperature 298K

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