3B7O
Crystal structure of the human tyrosine phosphatase SHP2 (PTPN11) with an accessible active site
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-07-15 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 1.00721 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 44.813, 86.496, 166.555 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 34.120 - 1.600 |
R-factor | 0.17204 |
Rwork | 0.170 |
R-free | 0.20897 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2shp |
RMSD bond length | 0.017 |
RMSD bond angle | 1.593 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.3.0040) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 34.120 | 1.690 |
High resolution limit [Å] | 1.600 | 1.600 |
Rmerge | 0.092 | 1.010 |
Number of reflections | 43184 | |
<I/σ(I)> | 13.3 | 2 |
Completeness [%] | 99.9 | 100 |
Redundancy | 4.1 | 4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | 20% PEG 3350, 0.15 M Na Malate, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K |