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3D7B

The Ribonuclease A- 5'-Deoxy-5'-N-pyrrolidinouridine complex

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSRS BEAMLINE PX9.6
Synchrotron siteSRS
BeamlinePX9.6
Temperature [K]100
Detector technologyCCD
Collection date2006-11-07
DetectorADSC QUANTUM 4
Wavelength(s)0.92
Spacegroup nameC 1 2 1
Unit cell lengths99.959, 32.540, 72.439
Unit cell angles90.00, 90.62, 90.00
Refinement procedure
Resolution30.000 - 1.600
R-factor0.18041
Rwork0.179
R-free0.21330
Structure solution methodFOURIER SYNTHESIS
Starting model (for MR): 2G8Q
RMSD bond length0.007
RMSD bond angle1.429
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareREFMAC
Refinement softwareREFMAC (5.3.0037)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0001.640
High resolution limit [Å]1.6001.600
Number of reflections30196
<I/σ(I)>11.73
Completeness [%]96.495.9
Redundancy3.23.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP5.5298PEG 4000, SODIUM CITRATE, pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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