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2B76

E. coli Quinol fumarate reductase FrdA E49Q mutation

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID13
Synchrotron siteESRF
BeamlineID13
Temperature [K]100
Detector technologyCCD
Collection date2003-06-01
DetectorADSC QUANTUM 4
Wavelength(s)0.9537
Spacegroup nameP 21 21 21
Unit cell lengths96.802, 139.527, 273.972
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution20.000 - 3.300
Rwork0.248
R-free0.28400
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1kf6
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0003.350
High resolution limit [Å]3.3003.300
Rmerge0.0980.256
Number of reflections47106
<I/σ(I)>4.1
Completeness [%]88.973.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP5.8298Mg Acetate, PEG 5000 MME, Na Citrate, EDTA, DTT, pH 5.8, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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