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2I0E

Structure of catalytic domain of human protein kinase C beta II complexed with a bisindolylmaleimide inhibitor

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsALS BEAMLINE 5.0.1
Synchrotron siteALS
Beamline5.0.1
Temperature [K]100
Detector technologyCCD
Collection date2004-09-04
DetectorADSC QUANTUM 210
Wavelength(s)1.0
Spacegroup nameP 21 21 2
Unit cell lengths93.098, 131.417, 83.801
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution30.000 - 2.600
R-factor0.23654
Rwork0.235
R-free0.28973
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)Akt-1
RMSD bond length0.010
RMSD bond angle1.329
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareAMoRE
Refinement softwareREFMAC (5.2.0005)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.690
High resolution limit [Å]2.6002.600
Rmerge0.049
Number of reflections32375
<I/σ(I)>28.43
Completeness [%]99.7100
Redundancy4.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.52860.1 M ADA, 2.5 M sodium acetate, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 286K

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