1JYQ
Xray Structure of Grb2 SH2 Domain Complexed with a Highly Affine Phospho Peptide
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF |
Synchrotron site | ESRF |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 1999-09-23 |
Wavelength(s) | 0.933 |
Spacegroup name | P 61 2 2 |
Unit cell lengths | 60.999, 60.999, 177.046 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 8.000 * - 2.000 |
R-factor | 0.185 * |
Rwork | 0.185 |
R-free | 0.25100 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.027 |
RMSD bond angle | 25.300 * |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | CNS (1.0) |
Data quality characteristics
Overall | Outer shell | |
High resolution limit [Å] | 2.000 | |
Rmerge | 0.057 * | 0.095 * |
Total number of observations | 434272 * | |
Number of reflections | 14016 * | |
Completeness [%] | 99.8 | 100 * |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | unknown * | 6 | 291 | Ammonium phosphate, PEG400, pH 6, VAPOR DIFFUSION, HANGING DROP, temperature 291K |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | 1 | ammonium phosphate | 2.3 (M) | |
2 | 1 | 1 | PEG400 | 4 (%(w/v)) | |
3 | 1 | 1 | sodium cacodylate | 50 (mM) | |
4 | 1 | 1 | protein | 19 (mg/ml) |