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3PBS

Crystal structure of PBP3 complexed with aztreonam

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 17-ID
Synchrotron siteAPS
Beamline17-ID
Temperature [K]100
Detector technologyCCD
Collection date2009-08-01
DetectorADSC QUANTUM 210
Wavelength(s)1.0
Spacegroup nameP 21 21 21
Unit cell lengths67.500, 83.830, 89.750
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution26.430 - 2.000
R-factor0.216
Rwork0.214
R-free0.25690
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.009
RMSD bond angle1.110
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHASES
Refinement softwareBUSTER (2.9.3)
Data quality characteristics
 Overall
Low resolution limit [Å]30.000
High resolution limit [Å]2.000
Number of reflections32925
Completeness [%]91.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8.529530% PEG4000, 0.2M MgCl2, 0.1M Tris, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 295K

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