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4A9Y

P38ALPHA MAP KINASE BOUND TO CMPD 8

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSRS BEAMLINE PX9.6
Synchrotron siteSRS
BeamlinePX9.6
Temperature [K]100
Detector technologyCCD
Collection date2002-10-07
DetectorADSC QUANTUM 4
Spacegroup nameP 21 21 21
Unit cell lengths66.332, 75.840, 78.112
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution30.000 - 2.200
R-factor0.21961
Rwork0.218
R-free0.24970
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.014
RMSD bond angle1.447
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwareAMoRE
Refinement softwareREFMAC (5.1.17)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]28.2802.320
High resolution limit [Å]2.2002.200
Rmerge0.0400.360
Number of reflections20591
<I/σ(I)>15.72
Completeness [%]87.587.5
Redundancy2.41.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.52986-10% PEG-MME 5000, PH 6.5, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 298K

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