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4NB2

Crystal Structure of FosB from Staphylococcus aureus at 1.89 Angstrom Resolution - Apo structure

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsBRUKER AXS MICROSTAR
Temperature [K]100
Detector technologyCCD
Collection date2010-10-06
DetectorBruker Platinum 135
Wavelength(s)1.54
Spacegroup nameP 1
Unit cell lengths40.608, 44.825, 45.665
Unit cell angles119.30, 106.79, 97.92
Refinement procedure
Resolution36.800 - 1.890
R-factor0.1885
Rwork0.186
R-free0.24080
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.020
RMSD bond angle2.027
Data reduction softwarePROTEUM PLUS (PLUS)
Data scaling softwareXSCALE
Phasing softwarePHASER (2.3.0)
Refinement softwareREFMAC
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]36.8001.940
High resolution limit [Å]1.8901.890
Rmerge0.343
Number of reflections18193
<I/σ(I)>2
Completeness [%]89.778.4
Redundancy1.27
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.5303PEG 3350, Ammonium Sulfate, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 303K

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