6C19
FGFR1 kinase complex with inhibitor SN36985
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 110 |
Detector technology | IMAGE PLATE |
Collection date | 2015-01-20 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 1.5418 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 208.426, 49.013, 64.628 |
Unit cell angles | 90.00, 105.97, 90.00 |
Refinement procedure
Resolution | 19.710 - 2.120 |
R-factor | 0.20704 |
Rwork | 0.205 |
R-free | 0.23852 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4wun |
RMSD bond length | 0.011 |
RMSD bond angle | 1.588 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 19.710 | 2.180 |
High resolution limit [Å] | 2.120 | 2.120 |
Rmerge | 0.080 | 0.682 |
Rpim | 0.034 | 0.293 |
Number of reflections | 21315 | 2944 |
<I/σ(I)> | 19.9 | 3.1 |
Completeness [%] | 99.9 | 100 |
Redundancy | 7.4 | 7.2 |
CC(1/2) | 0.999 | 0.854 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 291 | 20% MPEG 5000, 0.1 M sodium cacodylate pH 7.5, 0.2 M ammonium sulfate |