8B5Y
SHP2 in complex with allosteric imidazopyrazine inhibitor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X6A |
Synchrotron site | NSLS |
Beamline | X6A |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-09-07 |
Detector | DECTRIS EIGER2 S 16M |
Wavelength(s) | 0.999983 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 51.908, 190.263, 57.297 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 95.130 | 1.455 |
High resolution limit [Å] | 1.450 | 1.450 |
Rmerge | 0.185 | |
Rpim | 0.147 | |
Number of reflections | 97403 | 6235 |
<I/σ(I)> | 4.6 | |
Completeness [%] | 96.0 | 87.6 |
Redundancy | 2.3 | 1.9 |
CC(1/2) | 0.779 | 0.022 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293.15 | 21.00 %w/v PEG 3350, 0.30 M K Form |