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2X1N

Truncation and Optimisation of Peptide Inhibitors of CDK2, Cyclin A Through Structure Guided Design

Replaces:  2WHA
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID14-2
Synchrotron siteESRF
BeamlineID14-2
Temperature [K]100
Detector technologyCCD
Collection date2003-02-12
DetectorADSC CCD
Spacegroup nameP 21 21 21
Unit cell lengths74.558, 114.257, 157.277
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution30.000 - 2.750
R-factor0.20136
Rwork0.200
R-free0.25478
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1ol1
RMSD bond length0.013
RMSD bond angle1.548
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwareMOLREP
Refinement softwareREFMAC (5.2.0019)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0002.900
High resolution limit [Å]2.7502.750
Rmerge0.1400.670
Number of reflections37669
<I/σ(I)>12.71.9
Completeness [%]98.398.8
Redundancy3.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
17.8PEG3350 20% V/V, 0.1M TRI-SODIUM CITRATE, PH 7.8

217705

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