8U1F
FGFR2 Kinase Domain Bound to Irreversible Inhibitor Cmpd 10
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS-II BEAMLINE 17-ID-2 |
Synchrotron site | NSLS-II |
Beamline | 17-ID-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-05-16 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.9793 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 62.513, 88.280, 129.132 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 52.110 - 3.330 |
R-factor | 0.2689 |
Rwork | 0.268 |
R-free | 0.29540 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.003 |
RMSD bond angle | 0.709 |
Data reduction software | autoPROC |
Phasing software | PHASER |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 52.110 | 3.140 |
High resolution limit [Å] | 3.060 | 3.060 |
Rmerge | 0.136 | |
Number of reflections | 14247 | 6280 |
<I/σ(I)> | 4.5 | |
Completeness [%] | 97.1 | |
Redundancy | 5.5 | |
CC(1/2) | 0.970 | 0.353 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 291.15 | 0.1 M Tris pH 8, 18% PEG K |