8F1Z
EGFR kinase in complex with Bayer #33
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-E |
Synchrotron site | APS |
Beamline | 24-ID-E |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-03-11 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.97918 |
Spacegroup name | I 2 3 |
Unit cell lengths | 146.131, 146.131, 146.131 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 59.660 - 2.400 |
R-factor | 0.1927 |
Rwork | 0.192 |
R-free | 0.21160 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2gs2 |
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] | 59.660 | 59.680 | 2.440 |
High resolution limit [Å] | 2.400 | 6.510 | 2.400 |
Rmeas | 0.090 | 0.044 | 0.671 |
Rpim | 0.038 | 0.018 | 0.296 |
Total number of observations | 102981 | 5183 | 4858 |
Number of reflections | 20163 | 1049 | 1029 |
<I/σ(I)> | 11.2 | 36.6 | 0.9 |
Completeness [%] | 98.6 | 96.4 | 99.7 |
Redundancy | 5.1 | 4.9 | 4.7 |
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 |