7G8Q
ARHGEF2 PanDDA analysis group deposition -- ARHGEF2 and RhoA in complex with Z1269220427
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04-1 |
| Synchrotron site | Diamond |
| Beamline | I04-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-11-25 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.92124 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 71.177, 71.177, 196.336 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 35.590 - 1.561 |
| R-factor | 0.1873 |
| Rwork | 0.186 |
| R-free | 0.20710 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 8bnt |
| RMSD bond length | 0.010 |
| RMSD bond angle | 0.920 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.7.7) |
| Phasing software | REFMAC |
| Refinement software | BUSTER (2.10.4 (17-FEB-2023)) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 35.590 | 35.590 | 1.590 |
| High resolution limit [Å] | 1.560 | 8.550 | 1.560 |
| Rmerge | 0.232 | 0.056 | 5.548 |
| Rmeas | 0.237 | 0.058 | 5.692 |
| Rpim | 0.046 | 0.013 | 1.248 |
| Total number of observations | 1867269 | 10992 | 71912 |
| Number of reflections | 72640 | ||
| <I/σ(I)> | 9.6 | 49.3 | 0.6 |
| Completeness [%] | 99.9 | 99 | 99.5 |
| Redundancy | 25.7 | 19.7 | 20.4 |
| CC(1/2) | 0.999 | 0.999 | 0.362 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | 100 mM Tris, 2.6M sodium formate |
