6S9D
EGFR-KINASE IN COMPLEX WITH COMPOUND 6
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-08-31 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 1.00000 |
| Spacegroup name | I 2 3 |
| Unit cell lengths | 145.739, 145.739, 145.739 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 103.050 - 2.670 |
| R-factor | 0.1952 |
| Rwork | 0.194 |
| R-free | 0.22370 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | NONE |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.251 |
| 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] | 103.050 | 103.050 |
| High resolution limit [Å] | 2.670 | 2.670 |
| Rmerge | 0.076 | 0.447 |
| Rmeas | 0.261 | 0.034 |
| Total number of observations | 35946 | |
| Number of reflections | 14553 | 45 |
| <I/σ(I)> | 6.99 | 28.49 |
| Completeness [%] | 98.3 | 99.7 |
| Redundancy | 2.9 | 2.8 |
| CC(1/2) | 0.980 | 0.998 |
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 |
