8HV9
Crystal structure of EGFR_TMX in complex with covalently bound fragment 12
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | BRUKER TURBO X-RAY SOURCE |
| Temperature [K] | 110 |
| Detector technology | CMOS |
| Collection date | 2019-04-17 |
| Detector | BRUKER PHOTON 100 |
| Wavelength(s) | 1.54184 |
| Spacegroup name | I 2 3 |
| Unit cell lengths | 144.435, 144.435, 144.435 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 20.000 - 2.500 |
| R-factor | 0.25424 |
| Rwork | 0.253 |
| R-free | 0.27418 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5edq |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.595 |
| Data reduction software | SAINT |
| Data scaling software | SADABS |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 21.300 | 2.500 |
| High resolution limit [Å] | 2.400 | 2.400 |
| Rmerge | 0.152 | 0.684 |
| Number of reflections | 18682 | 2249 |
| <I/σ(I)> | 6.79 | 1.23 |
| Completeness [%] | 94.6 | 99.7 |
| Redundancy | 4.05 | 3.47 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 292 | 0.1M TRIS pH 8.5, 0.15M Sodium citrate, 25%PEG400 |
