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4IAY

Room temperature X-ray Structure of cAMP dependent protein kinase A in complex with high Sr2+ concentration, ADP and phosphorylated peptide pSP20

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU MICROMAX-007 HF
Temperature [K]293
Detector technologyIMAGE PLATE
Collection date2012-03-01
DetectorRIGAKU RAXIS IV++
Wavelength(s)1.54
Spacegroup nameP 21 21 21
Unit cell lengths59.484, 80.014, 100.177
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution20.000 - 2.000
R-factor0.1819
Rwork0.179
R-free0.22700
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.015
RMSD bond angle1.420
Data reduction softwareHKL-3000
Data scaling softwareHKL-3000
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 Overall
Low resolution limit [Å]40.000
High resolution limit [Å]2.000
Number of reflections23809
Completeness [%]84.0
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP6.5277100 mM MES pH 6.5, 5 mM DTT, 15-20% PEG 4000, VAPOR DIFFUSION, SITTING DROP, temperature 277K

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