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2OEN

Structural mechanism for the fine-tuning of CcpA function by the small molecule effectors glucose-6-phosphate and fructose-1,6-bisphosphate

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsALS BEAMLINE 8.2.1
Synchrotron siteALS
Beamline8.2.1
Temperature [K]100
Detector technologyCCD
Collection date2005-12-23
DetectorADSC QUANTUM 315
Spacegroup nameP 41 21 2
Unit cell lengths69.330, 69.330, 229.500
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution66.370 - 3.170
R-factor0.278
Rwork0.278
R-free0.31800
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2nzu
RMSD bond length0.016
RMSD bond angle2.300
Data reduction softwareMOSFLM
Data scaling softwareCCP4 ((SCALA))
Phasing softwareMOLREP
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]66.4003.370
High resolution limit [Å]3.1703.170
Rmerge0.0560.340
Number of reflections10070
<I/σ(I)>121.2
Completeness [%]98.999.1
Redundancy22
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.6298ammonium sulphate, pH 6.6, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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