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4K7M

Crystal structure of RNase S variant (K7C/Q11C) with bound mercury ions

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsBRUKER AXS MICROSTAR
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2010-02-09
DetectorMAR scanner 345 mm plate
Wavelength(s)1.54179
Spacegroup nameP 31 2 1
Unit cell lengths43.870, 43.870, 96.361
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution21.930 - 1.800
R-factor0.16684
Rwork0.165
R-free0.20456
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)PDB ID 2RNS
RMSD bond length0.018
RMSD bond angle1.992
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Refinement softwareREFMAC (5.7.0029)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]21.9351.900
High resolution limit [Å]1.8001.800
Number of reflections10484
Completeness [%]99.899.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP3.92920.1 M Citric Acid, 2.1 M Ammonium Sulfate, pH 3.9, VAPOR DIFFUSION, HANGING DROP, temperature 292K

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