6S9C
EGFR-KINASE IN COMPLEX WITH COMPOUND 5
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-12-08 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.999999701977 |
| Spacegroup name | I 2 3 |
| Unit cell lengths | 145.447, 145.447, 145.447 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 102.850 - 2.730 |
| R-factor | 0.2015 |
| Rwork | 0.200 |
| R-free | 0.22480 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | NONE |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.262 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 102.850 | 102.850 |
| High resolution limit [Å] | 2.730 | 2.730 |
| Rmerge | 0.059 | 0.420 |
| Rmeas | 0.067 | 0.022 |
| Total number of observations | 57792 | |
| Number of reflections | 13483 | 54 |
| <I/σ(I)> | 18.57 | 53.63 |
| Completeness [%] | 95.9 | 87.3 |
| Redundancy | 4.3 | 4.3 |
| CC(1/2) | 0.998 | 0.999 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 10 % PEG 10000 8 % ethylene glycol 0.1 M HEPES |
