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2A30

Crystal structure of human deoxycytidine kinase in complex with deoxycytidine

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 22-ID
Synchrotron siteAPS
Beamline22-ID
Temperature [K]100
Detector technologyCCD
Collection date2004-04-08
DetectorMARRESEARCH
Wavelength(s)0.97626
Spacegroup nameP 1 21 1
Unit cell lengths79.337, 64.941, 108.602
Unit cell angles90.00, 95.97, 90.00
Refinement procedure
Resolution19.900 - 3.020
R-factor0.24
Rwork0.235
R-free0.28500
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1p60
RMSD bond length0.009
RMSD bond angle1.200
Data reduction softwareMOSFLM
Data scaling softwareXSCALE
Phasing softwareAMoRE
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]40.0003.100
High resolution limit [Å]3.0003.000
Rmerge0.1410.642
Number of reflections200401124
<I/σ(I)>8.772.36
Completeness [%]83.781.2
Redundancy3.33.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.5298PEG 1000, MPD, Calcium Chloride, Sodium Cacodylate, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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