9ZPN
WNK1/S382A kinase domain in complex with potassium formate, x-ray wavelength 3.3968 Angstroms
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-06-30 |
| Detector | DECTRIS EIGER2 X 16M |
| Wavelength(s) | 3.3968 |
| Spacegroup name | P 1 |
| Unit cell lengths | 38.360, 57.529, 65.521 |
| Unit cell angles | 89.04, 89.72, 89.28 |
Refinement procedure
| Resolution | 38.360 - 2.250 |
| R-factor | 0.1776 |
| Rwork | 0.174 |
| R-free | 0.24010 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.897 |
| Data reduction software | FAST_DP |
| Data scaling software | xia2 |
| Phasing software | MOLREP |
| Refinement software | PHENIX ((1.21.2_5419: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 38.600 | 2.371 |
| High resolution limit [Å] | 2.200 | 2.250 |
| Rmerge | 0.183 | |
| Number of reflections | 24252 | 2696 |
| <I/σ(I)> | 6.8 | |
| Completeness [%] | 84.4 | 73.22 |
| Redundancy | 5 | 2.3 |
| CC(1/2) | 0.977 | 0.316 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.4 | 289 | 50 mM Tris/HCl pH 7.4 5 mM EDTA 200 mM potassium formate 20% PEG 3350 |
