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5B2K

A crucial role of Cys218 in the stabilization of an unprecedented auto-inhibition form of MAP2K7

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL44XU
Synchrotron siteSPring-8
BeamlineBL44XU
Temperature [K]100
Detector technologyCCD
Collection date2014-06-30
DetectorRAYONIX MX225HE
Wavelength(s)0.9
Spacegroup nameP 61 2 2
Unit cell lengths71.394, 71.394, 261.996
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution44.960 - 2.750
R-factor0.27261
Rwork0.270
R-free0.32761
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3wzu
RMSD bond length0.012
RMSD bond angle1.766
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareMOLREP
Refinement softwareREFMAC (5.6.0117)
Data quality characteristics
 Overall
Low resolution limit [Å]50.000
High resolution limit [Å]2.750
Number of reflections11135
<I/σ(I)>22.7
Completeness [%]95.0
Redundancy13.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP7.5277PEG 3350, sodium citrate tribasic, Hepes

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