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7A4O

Structure of DYRK1A in complex with AMPNP

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsDIAMOND BEAMLINE I02
Synchrotron siteDiamond
BeamlineI02
Temperature [K]100
Detector technologyCCD
Collection date2009-05-13
DetectorADSC QUANTUM 315r
Wavelength(s)0.9796
Spacegroup nameP 1 21 1
Unit cell lengths65.145, 84.731, 76.342
Unit cell angles90.00, 108.21, 90.00
Refinement procedure
Resolution20.000 - 1.900
R-factor0.1803
Rwork0.179
R-free0.20300
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2vx3
RMSD bond length0.009
RMSD bond angle1.594
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareMOLREP
Refinement softwareREFMAC (5.8.0258)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.970
High resolution limit [Å]1.9001.900
Rmerge0.1090.710
Number of reflections602455677
<I/σ(I)>11.91.4
Completeness [%]96.9
Redundancy3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION6.52930.1M MES buffer at pH 6.5, 12% Peg3350, 0.2M MgCl2

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