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6C84

Crystal structure of PBP5 from Enterococcus faecium

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 21-ID-D
Synchrotron siteAPS
Beamline21-ID-D
Temperature [K]100
Detector technologyCCD
Collection date2015-04-25
DetectorMARMOSAIC 300 mm CCD
Wavelength(s)0.9870
Spacegroup nameP 1 21 1
Unit cell lengths110.977, 73.071, 131.445
Unit cell angles90.00, 114.97, 90.00
Refinement procedure
Resolution29.790 - 2.511
R-factor0.2251
Rwork0.224
R-free0.26500
RMSD bond length0.006
RMSD bond angle0.831
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHASER
Refinement softwarePHENIX (1.12_2829)
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]30.00030.0002.550
High resolution limit [Å]2.5106.7902.510
Rmerge0.0960.0400.829
Rmeas0.1120.0470.967
Rpim0.0570.0250.495
Total number of observations246829
Number of reflections6530133893220
<I/σ(I)>10.4
Completeness [%]100.099.6100
Redundancy3.83.53.8
CC(1/2)0.9970.749
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP0.2 M Mg acetate, 0.1 M Na cacodylate pH 6.5, 5% PEG 8000

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