9FZR
Wild-type EGFR in covalent complex with Poziotinib analogue
This is a non-PDB format compatible entry.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-02-12 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.898423 |
Spacegroup name | I 2 3 |
Unit cell lengths | 145.823, 145.823, 145.823 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 59.603 - 1.991 |
Rwork | 0.186 |
R-free | 0.23320 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 1.723 |
Data reduction software | xia2 |
Data scaling software | pointless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0430 (refmacat 0.4.82)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 59.603 | 2.040 |
High resolution limit [Å] | 1.990 | 1.990 |
Rmerge | 0.101 | 5.430 |
Number of reflections | 35412 | 105527 |
<I/σ(I)> | 24 | |
Completeness [%] | 100.0 | 100 |
Redundancy | 41 | |
CC(1/2) | 1.000 | 0.396 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8 | 293 | 25mM TRIS-HCL pH8.0, 150mM NaCl, 5% Glycerol, 1mM TCEP, 100mM HEPES pH 7.4, 40% PEG400 |