8D76
Crystal Structure of EGFR LRTM with compound 24
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04-1 |
| Synchrotron site | Diamond |
| Beamline | I04-1 |
| Temperature [K] | 110 |
| Detector technology | PIXEL |
| Collection date | 2018-07-18 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.9159 |
| Spacegroup name | P 1 |
| Unit cell lengths | 41.535, 50.316, 85.875 |
| Unit cell angles | 104.19, 101.73, 90.12 |
Refinement procedure
| Resolution | 30.000 - 2.400 |
| R-factor | 0.1613 |
| Rwork | 0.156 |
| R-free | 0.26000 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4i22 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.360 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0232) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.700 | 2.430 |
| High resolution limit [Å] | 2.390 | 2.390 |
| Rmeas | 0.080 | 0.630 |
| Number of reflections | 25531 | 1289 |
| <I/σ(I)> | 10.8 | 2.2 |
| Completeness [%] | 98.0 | 96.9 |
| Redundancy | 3.5 | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 285 | 0.1 M sodium acetate pH 5.3, 0.2 M potassium acetate, 3% PEG 8000. |
