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5VHU

E. coli CFT073 c3406

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 21-ID-G
Synchrotron siteAPS
Beamline21-ID-G
Temperature [K]77
Detector technologyCCD
Collection date2013-10-11
DetectorMARMOSAIC 300 mm CCD
Wavelength(s)0.978
Spacegroup nameI 2 2 2
Unit cell lengths71.832, 71.489, 77.234
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution52.600 - 1.800
R-factor0.17523
Rwork0.174
R-free0.20806
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3fxa
RMSD bond length0.019
RMSD bond angle1.827
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareMOLREP
Refinement softwareREFMAC (5.8.0158)
Data quality characteristics
 Overall
Low resolution limit [Å]52.600
High resolution limit [Å]1.800
Number of reflections17785
<I/σ(I)>10.7
Completeness [%]99.8
Redundancy14.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP5.62940.1 M sodium citrate tribasic pH 5.6, 0.5 M NaCl, 2% v/v ethylene imine polymer

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