7G8G
ARHGEF2 PanDDA analysis group deposition -- ARHGEF2 and RhoA in complex with Z111529496
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 | 2022-11-23 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.92124 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 71.276, 71.276, 196.190 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 18.920 - 1.920 |
| R-factor | 0.2107 |
| Rwork | 0.209 |
| R-free | 0.25100 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 8bnt |
| RMSD bond length | 0.008 |
| 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] | 71.260 | 71.260 | 1.970 |
| High resolution limit [Å] | 1.920 | 9.010 | 1.920 |
| Rmerge | 0.412 | 0.059 | 9.302 |
| Rmeas | 0.420 | 0.060 | 9.470 |
| Rpim | 0.080 | 0.013 | 1.761 |
| Total number of observations | 1055609 | 9303 | 73062 |
| Number of reflections | 39522 | ||
| <I/σ(I)> | 6.2 | 37.4 | 0.4 |
| Completeness [%] | 99.7 | 100 | 99 |
| Redundancy | 26.7 | 19.1 | 28.3 |
| CC(1/2) | 0.997 | 0.999 | 0.453 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | 100 mM Tris, 2.6M sodium formate |
