7U9A
EGFR 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 | 145.825, 145.825, 145.825 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 103.110 - 2.600 |
R-factor | 0.1957 |
Rwork | 0.194 |
R-free | 0.22600 |
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] | 103.110 | 103.190 | 2.650 |
High resolution limit [Å] | 2.600 | 7.060 | 2.600 |
Rmeas | 0.125 | 0.058 | 1.391 |
Rpim | 0.055 | 0.026 | 0.606 |
Total number of observations | 80669 | 4015 | 3989 |
Number of reflections | 16002 | 855 | 778 |
<I/σ(I)> | 10.4 | 29.4 | 1 |
Completeness [%] | 99.9 | 99.2 | 100 |
Redundancy | 5 | 4.7 | 5.1 |
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 |