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4F16

Crystal Structure of the alpha spectrin SH3 domain at pH 5

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE BM16
Synchrotron siteESRF
BeamlineBM16
Temperature [K]100
Detector technologyCCD
Collection date2008-03-03
DetectorADSC QUANTUM 210r
Spacegroup nameP 21 21 21
Unit cell lengths32.720, 42.336, 50.335
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution19.510 - 1.930
R-factor0.214
Rwork0.212
R-free0.25400
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1shg
RMSD bond length0.008
RMSD bond angle1.030
Data reduction softwareDENZO
Data scaling softwareSCALA
Phasing softwareMOLREP
Refinement softwarePHENIX (1.7.3-928)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]20.0002.000
High resolution limit [Å]1.9301.930
Rmerge0.0700.199
Number of reflections5427
<I/σ(I)>16.6
Completeness [%]96.478
Redundancy5.54.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
152980.1M Sodium Acetate, 30% PEG 8000, pH 5, capillary counterdiffusion, temperature 298K

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