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5OEH

Molecular tweezers modulate 14-3-3 protein-protein interactions.

Replaces:  4HQW
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSLS BEAMLINE X10SA
Synchrotron siteSLS
BeamlineX10SA
Temperature [K]100
Detector technologyPIXEL
Collection date2012-09-20
DetectorPSI PILATUS 6M
Wavelength(s)1.00
Spacegroup nameC 2 2 2
Unit cell lengths60.400, 157.400, 77.200
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution45.540 - 2.350
R-factor0.2048
Rwork0.202
R-free0.26350
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3lw1
RMSD bond length0.009
RMSD bond angle1.221
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwarePHASER (2.3.0)
Refinement softwareREFMAC (5.8.0158)
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]45.54045.5402.400
High resolution limit [Å]2.3504.0002.350
Rmerge0.0560.0390.467
Rmeas0.0590.0420.493
Number of reflections157453329942
<I/σ(I)>22.4445.484.74
Completeness [%]99.999.8100
Redundancy9.1998.8219.63
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION277.150.09 M HEPES sodium salt, 1.26 M Tri-Sodium Citrate, 10 % Glycerol, pH 7.5

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