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5J2L

De novo design of protein homo-oligomers with modular hydrogen bond network-mediated specificity

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsALS BEAMLINE 8.2.2
Synchrotron siteALS
Beamline8.2.2
Temperature [K]100
Detector technologyCCD
Collection date2015-01-28
DetectorADSC QUANTUM 315r
Wavelength(s)1.0
Spacegroup nameP 1 21 1
Unit cell lengths35.380, 45.700, 48.320
Unit cell angles90.00, 97.43, 90.00
Refinement procedure
Resolution35.080 - 1.960
R-factor0.2094
Rwork0.206
R-free0.24190
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.013
RMSD bond angle1.126
Data reduction softwarexia2
Data scaling softwarexia2
Phasing softwarePHASER
Refinement softwarePHENIX (dev_1616)
Data quality characteristics
 Overall
Low resolution limit [Å]35.080
High resolution limit [Å]1.960
Rmerge0.056
Number of reflections11050
<I/σ(I)>23.1
Completeness [%]99.4
Redundancy7.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP2930.1 M Tris pH 8.5 and 2.0 M Ammonium sulfate

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