7G8W
ARHGEF2 PanDDA analysis group deposition -- ARHGEF2 and RhoA in complex with Z1416193393
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 | 2022-11-24 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.92124 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 71.430, 71.430, 196.336 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 67.130 - 1.939 |
| R-factor | 0.2103 |
| Rwork | 0.208 |
| R-free | 0.25040 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 8bnt |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.930 |
| 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] | 71.430 | 71.430 | 1.980 |
| High resolution limit [Å] | 1.940 | 9.090 | 1.940 |
| Rmerge | 0.780 | 0.092 | 8.530 |
| Rmeas | 0.795 | 0.094 | 8.688 |
| Rpim | 0.153 | 0.021 | 1.638 |
| Total number of observations | 1031338 | 9282 | 70906 |
| Number of reflections | 38770 | ||
| <I/σ(I)> | 4.5 | 26.9 | 0.5 |
| Completeness [%] | 99.9 | 100 | 98.9 |
| Redundancy | 26.6 | 19.3 | 28 |
| CC(1/2) | 0.990 | 0.998 | 0.371 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | 100 mM Tris, 2.6M sodium formate |
