6JQR
Crystal structure of FLT3 in complex with gilteritinib
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-05-17 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.9999 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 82.367, 82.367, 146.469 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 71.790 - 2.200 |
R-factor | 0.181 |
Rwork | 0.179 |
R-free | 0.21300 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.012 |
RMSD bond angle | 1.587 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Refinement software | REFMAC (5.8.0155) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 71.790 | 2.450 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.040 | 0.441 |
Number of reflections | 24524 | |
<I/σ(I)> | 49.61 | |
Completeness [%] | 93.1 | 81.8 |
Redundancy | 15.7 | 16.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 293 | buffer, salt, precipitant |