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3AT0

Structural and biochemical characterization of ClfB:ligand interactions

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RU300
Temperature [K]120
Wavelength(s)1.54
Spacegroup nameP 43
Unit cell lengths86.238, 86.238, 83.864
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution28.750 - 2.500
R-factor0.1793
Rwork0.178
R-free0.20730
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.016
RMSD bond angle1.550
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHASER
Refinement softwareREFMAC (5.2.0019)
Data quality characteristics
 Overall
High resolution limit [Å]2.500
Number of reflections21349
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION82980.9M sodium citrate, 90mM imidazole pH 8.0, VAPOR DIFFUSION, temperature 298K

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