9BLG
Crystal structure of non-receptor protein tyrosine phosphatase SHP2 in complex with PF-07284892
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU FR-E SUPERBRIGHT |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-03-14 |
| Detector | DECTRIS PILATUS3 R 1M |
| Wavelength(s) | 1.54 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 45.270, 214.270, 55.810 |
| Unit cell angles | 90.00, 96.06, 90.00 |
Refinement procedure
| Resolution | 28.270 - 2.060 |
| R-factor | 0.1901 |
| Rwork | 0.188 |
| R-free | 0.23810 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.489 |
| Data reduction software | iMOSFLM |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.19.1_4122) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 28.270 | 2.140 |
| High resolution limit [Å] | 2.060 | 2.060 |
| Rmeas | 0.077 | 0.244 |
| Rpim | 0.029 | 0.097 |
| Number of reflections | 61141 | 8644 |
| <I/σ(I)> | 17.6 | 7.2 |
| Completeness [%] | 94.3 | |
| Redundancy | 6.9 | |
| CC(1/2) | 0.998 | 0.973 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 9.2 | 293 | 9%PEG3350, 0.1M Bicine, pH9.2, 30mM Ammonium Acetate, 5% Tacsimate |
