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2DF6

Crystal Structure of the SH3 Domain of betaPIX in Complex with a High Affinity Peptide from PAK2

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsNSLS BEAMLINE X9A
Synchrotron siteNSLS
BeamlineX9A
Temperature [K]100
Detector technologyCCD
Collection date2001-09-07
DetectorMARRESEARCH
Wavelength(s)0.979191
Spacegroup nameP 61
Unit cell lengths50.217, 50.217, 100.317
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution30.000 - 1.300
R-factor0.204
Rwork0.201
R-free0.21500
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2g6f
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0001.320
High resolution limit [Å]1.3001.300
Number of reflections35167
Completeness [%]99.799.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.7277100mM MES, 35% PEG 5000MME, 200mM ammonium sulfate, pH 6.7, VAPOR DIFFUSION, HANGING DROP, temperature 277K

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