7U99
EGFR kinase in complex with a macrocyclic inhibitor
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 24-ID-C |
| Synchrotron site | APS |
| Beamline | 24-ID-C |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-07-23 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.97918 |
| Spacegroup name | I 2 3 |
| Unit cell lengths | 145.532, 145.532, 145.532 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 102.910 - 2.500 |
| R-factor | 0.1886 |
| Rwork | 0.187 |
| R-free | 0.21390 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6vhp |
| Data reduction software | xia2 |
| Data scaling software | xia2 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 102.910 | 102.990 | 2.540 |
| High resolution limit [Å] | 2.500 | 6.790 | 2.500 |
| Rmeas | 0.112 | 0.058 | 1.164 |
| Rpim | 0.048 | 0.025 | 0.497 |
| Total number of observations | 90487 | 4502 | 4679 |
| Number of reflections | 17751 | 916 | 900 |
| <I/σ(I)> | 10.1 | 29.5 | 1 |
| Completeness [%] | 99.1 | 95.1 | 99.6 |
| Redundancy | 5.1 | 4.9 | 5.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 0.1 M MES pH 6.5, 1.1 M Sodium Citrate |
