4GFU
PTPN18 in complex with HER2-pY1248 phosphor-peptides
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U |
Synchrotron site | SSRF |
Beamline | BL17U |
Temperature [K] | 100 |
Detector technology | DIFFRACTOMETER |
Collection date | 2011-08-07 |
Detector | SYNTEX |
Wavelength(s) | 0.98 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 44.032, 71.766, 57.161 |
Unit cell angles | 90.00, 99.52, 90.00 |
Refinement procedure
Resolution | 33.260 - 2.000 |
R-factor | 0.1915 |
Rwork | 0.189 |
R-free | 0.23190 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2oc3 |
RMSD bond length | 0.006 |
RMSD bond angle | 1.016 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX ((phenix.refine: 1.6.2_432)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 80.000 | 2.091 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.075 | |
Number of reflections | 22674 | |
Completeness [%] | 95.3 | 98 |
Redundancy | 3.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.8 | 295.15 | 18%-22% PEG4K, 6% Jeffamine M 600, 0.1 M HEPES, pH 6.8, VAPOR DIFFUSION, HANGING DROP, temperature 295.15K |
1 | VAPOR DIFFUSION, HANGING DROP | 6.8 | 295.15 | 18%-22% PEG4K, 6% Jeffamine M 600, 0.1 M HEPES, pH 6.8, VAPOR DIFFUSION, HANGING DROP, temperature 295.15K |