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2XJF

Crystal structure of the D52N variant of cytosolic 5'-nucleotidase II with a covalently modified Asn52

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID23-2
Synchrotron siteESRF
BeamlineID23-2
Temperature [K]100
Detector technologyCCD
Collection date2007-11-02
DetectorMARMOSAIC 225 mm CCD
Spacegroup nameI 2 2 2
Unit cell lengths92.095, 128.222, 130.439
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution65.230 - 2.100
R-factor0.18084
Rwork0.178
R-free0.22517
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2jc9
RMSD bond length0.018
RMSD bond angle1.625
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwareMOLREP
Refinement softwareREFMAC (5.2.0019)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.210
High resolution limit [Å]2.1002.100
Rmerge0.1100.440
Number of reflections43556
<I/σ(I)>11.72.9
Completeness [%]96.498.1
Redundancy55
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
10.1 M BICINE PH 9.0, 10% PEG 6000.

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