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3CIR

E. coli Quinol fumarate reductase FrdA T234A mutation

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRL BEAMLINE BL11-1
Synchrotron siteSSRL
BeamlineBL11-1
Temperature [K]100
Detector technologyCCD
Collection date2006-05-31
DetectorADSC QUANTUM 315
Wavelength(s)1.0
Spacegroup nameP 21 21 21
Unit cell lengths96.861, 135.468, 266.024
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution266.000 - 3.650
Rwork0.261
R-free0.29570
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2b76
RMSD bond length0.011
RMSD bond angle1.913
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]266.0003.710
High resolution limit [Å]3.6503.650
Number of reflections32532
<I/σ(I)>2.5
Completeness [%]80.755.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP5.829810% PEG 5000 MME, 0.250M magnesium acetate, 100mM citric acid, 0.001M EDTA, pH 5.8, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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