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7UIQ

Cocrystal structure of human CaMKII-alpha (CAMK2A)kinase domain and Tiam1

Replaces:  6X8V
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU MICROMAX-007 HF
Temperature [K]100
Detector technologyPIXEL
Collection date2019-04-22
DetectorDECTRIS PILATUS3 R 200K-A
Wavelength(s)1.5418
Spacegroup nameP 21 21 21
Unit cell lengths43.433, 137.416, 156.473
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution31.540 - 3.110
R-factor0.2609
Rwork0.259
R-free0.30920
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)6vzk
RMSD bond length0.007
RMSD bond angle1.579
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHASER
Refinement softwareREFMAC (5.8.0258)
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]50.00050.0003.170
High resolution limit [Å]3.1108.4603.120
Rmerge0.2660.1340.670
Rmeas0.3000.1500.783
Rpim0.1340.0660.395
Number of reflections16346977747
<I/σ(I)>3.9
Completeness [%]93.497.691.9
Redundancy4.65.23.5
CC(1/2)0.9750.565
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP72770.1 M HEPES, 16% PEG 6000, 0.1% v/v Triton X-114

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