6GCX
Focal Adhesion Kinase catalytic domain in complex with irreversible inhibitor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALBA BEAMLINE XALOC |
Synchrotron site | ALBA |
Beamline | XALOC |
Temperature [K] | 80 |
Detector technology | PIXEL |
Collection date | 2017-07-05 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.98 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 45.868, 47.172, 63.432 |
Unit cell angles | 90.00, 98.50, 90.00 |
Refinement procedure
Resolution | 45.364 - 1.553 |
R-factor | 0.1857 |
Rwork | 0.184 |
R-free | 0.21860 |
RMSD bond length | 0.006 |
RMSD bond angle | 0.951 |
Data reduction software | XDS |
Data scaling software | autoPROC |
Refinement software | PHENIX ((1.12_2829: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.364 | 1.600 |
High resolution limit [Å] | 1.550 | 1.550 |
Rmerge | 0.050 | 0.452 |
Rmeas | 0.069 | 0.619 |
Rpim | 0.047 | 0.421 |
Number of reflections | 35549 | |
<I/σ(I)> | 10.7 | 2.1 |
Completeness [%] | 91.4 | 99.12 |
Redundancy | 3.1 | |
CC(1/2) | 0.988 | 0.724 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | EVAPORATION | 8.5 | 291.1 | 7.7mg/ml PEG4K LiSO4 |