6PL3
TRK-A IN COMPLEX WITH LIGAND 2a
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I02 |
Synchrotron site | Diamond |
Beamline | I02 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-01-28 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 0.9282 |
Spacegroup name | P 31 1 2 |
Unit cell lengths | 52.746, 52.746, 232.764 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 45.000 - 3.000 |
R-factor | 0.21124 |
Rwork | 0.206 |
R-free | 0.27225 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 0.998 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 77.590 | 3.250 |
High resolution limit [Å] | 3.000 | 3.000 |
Rmerge | 0.116 | 0.440 |
Number of reflections | 7476 | |
<I/σ(I)> | 10.28 | |
Completeness [%] | 96.1 | 97.5 |
Redundancy | 2.9 | 2.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 277.15 | pH 8.5 |