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3U01

Crystal structure of onconase double mutant C30A/C75A at 1.12 A resolution

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSEALED TUBE
Source detailsOXFORD DIFFRACTION ENHANCE ULTRA
Temperature [K]110
Detector technologyCCD
Collection date2010-01-08
DetectorAGILENT ATLAS CCD
Wavelength(s)1.54
Spacegroup nameP 21 21 21
Unit cell lengths32.288, 38.664, 69.514
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution34.757 - 1.120
R-factor0.13708
Rwork0.136
R-free0.14956
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1onc
RMSD bond length0.008
RMSD bond angle1.272
Data reduction softwareCrysalisPro
Data scaling softwareSCALA (3.3.16)
Phasing softwarePHASER
Refinement softwareREFMAC
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]34.7571.150
High resolution limit [Å]1.1201.120
Rmerge0.344
Number of reflections33823
<I/σ(I)>7.51.8
Completeness [%]97.583.9
Redundancy2.91.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP4.529330% PEG8000, 0.2 M lithium sulfate, 100 mM sodium acetate, pH 4.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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