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1ZZL

Crystal structure of P38 with triazolopyridine

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RU200
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2004-12-10
DetectorRIGAKU RAXIS
Spacegroup nameP 21 21 21
Unit cell lengths45.457, 86.631, 122.857
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution30.000 - 2.000
R-factor0.223
Rwork0.220
R-free0.27300
Structure solution methodFOURIER SYNTHESIS
RMSD bond length0.022
RMSD bond angle1.796
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareREFMAC (5.1.24)
Data quality characteristics
 Overall
Low resolution limit [Å]30.000
High resolution limit [Å]2.000
Number of reflections28614
Completeness [%]90.0
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8298Na.K Tartrate, Trimethylamine, Tris, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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