7F3M
Crystal structure of FGFR4 kinase domain with PRN1371
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | Cu FINE FOCUS |
Temperature [K] | 85 |
Detector technology | IMAGE PLATE |
Collection date | 2020-06-09 |
Detector | RIGAKU |
Wavelength(s) | 1.5870 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 42.449, 61.100, 61.041 |
Unit cell angles | 90.00, 97.65, 90.00 |
Refinement procedure
Resolution | 42.990 - 2.289 |
R-factor | 0.1896 |
Rwork | 0.187 |
R-free | 0.23710 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4qrc |
RMSD bond length | 0.003 |
RMSD bond angle | 0.694 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | PHENIX |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 42.990 | 2.371 |
High resolution limit [Å] | 2.289 | 2.289 |
Rmerge | 0.092 | 0.244 |
Rmeas | 0.112 | |
Number of reflections | 13012 | 930 |
<I/σ(I)> | 7.87 | 2.87 |
Completeness [%] | 92.2 | 66.1 |
Redundancy | 2.7 | 1.9 |
CC(1/2) | 0.990 | 0.876 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.5 | 277.15 | 0.1 M Bis-Tris (pH 4.5), 0.2 M Li2SO4, 18 % PEG 3350 |