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3R48

Crystal structure of a hetero-hexamer coiled coil

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsDIAMOND BEAMLINE I04
Synchrotron siteDiamond
BeamlineI04
Temperature [K]100
Detector technologyCCD
Collection date2010-10-10
DetectorADSC QUANTUM 315
Spacegroup nameC 1 2 1
Unit cell lengths148.872, 50.850, 31.681
Unit cell angles90.00, 91.05, 90.00
Refinement procedure
Resolution37.212 - 2.001
R-factor0.2132
Rwork0.210
R-free0.27680
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)SEMI-REFINED PDB ENTRY 3R46
RMSD bond length0.015
RMSD bond angle0.854
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwarePHASER
Refinement softwarePHENIX (1.7_650)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.070
High resolution limit [Å]2.0002.000
Rmerge0.0980.398
Number of reflections14338
<I/σ(I)>161.8
Completeness [%]88.946.2
Redundancy6.33.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP6.52910.2M sodium chloride, 0.1M sodium/potassium phosphate pH 6.5, 25% w/v PEG 1000, VAPOR DIFFUSION, SITTING DROP, temperature 291K

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