5D0J
Grb7 SH2 with inhibitor peptide
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
Synchrotron site | Australian Synchrotron |
Beamline | MX2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-08-10 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.954 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 33.980, 94.040, 131.490 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 38.245 - 2.600 |
R-factor | 0.1899 |
Rwork | 0.187 |
R-free | 0.24570 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2qms |
RMSD bond length | 0.007 |
RMSD bond angle | 1.077 |
Data reduction software | xia2 |
Data scaling software | xia2 |
Phasing software | MOLREP |
Refinement software | PHENIX |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.245 | 2.693 |
High resolution limit [Å] | 2.600 | 2.600 |
Rmerge | 0.179 | |
Number of reflections | 13653 | |
<I/σ(I)> | 9.56 | 2.83 |
Completeness [%] | 99.8 | 99.55 |
Redundancy | 10.2 | 10.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 293 | sodium fluoride, PEG 3350 |