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3PBT

Crystal structure of PBP3 complexed with MC-1

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 lengths67.772, 83.768, 89.569
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution61.120 - 1.641
R-factor0.1752
Rwork0.174
R-free0.20607
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.008
RMSD bond angle1.698
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHASER
Refinement softwareREFMAC (5.4.0069)
Data quality characteristics
 Overall
Low resolution limit [Å]61.120
High resolution limit [Å]1.640
Number of reflections62097
Completeness [%]99.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.20.1M citrate, 30% PEG3350, 0.3M Mg(NO3)2, pH 6.2, VAPOR DIFFUSION, HANGING DROP

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