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3MXC

Structures of Grb2-SH2 Domain and AICD peptide Complexes Reveal a Conformational Switch and Their Functional Implications.

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsBRUKER AXS MICROSTAR
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2009-07-02
DetectorMAR scanner 345 mm plate
Spacegroup nameP 61 2 2
Unit cell lengths59.369, 59.369, 117.101
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution29.690 - 2.000
R-factor0.217
Rwork0.217
R-free0.24400
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1jyr
RMSD bond length0.015
RMSD bond angle1.600
Data reduction softwareAUTOMAR
Phasing softwareAMoRE
Refinement softwareCNS (1.2)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0002.090
High resolution limit [Å]2.0002.000
Rmerge0.0420.270
Number of reflections8497
<I/σ(I)>5.92.1
Completeness [%]95.395
Redundancy5.485.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
12930.1 M Tris ,0.1M Bicine, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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