7G9G
ARHGEF2 PanDDA analysis group deposition -- ARHGEF2 and RhoA in complex with PCM-0102236-001
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 | 2023-03-02 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.92124 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 70.485, 70.485, 195.664 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 66.310 - 2.079 |
| R-factor | 0.2343 |
| Rwork | 0.232 |
| R-free | 0.28650 |
| 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] | 97.880 | 97.880 | 2.140 |
| High resolution limit [Å] | 2.080 | 8.830 | 2.080 |
| Rmerge | 0.546 | 0.073 | |
| Rmeas | 0.557 | 0.075 | 31.838 |
| Rpim | 0.108 | 0.017 | 5.955 |
| Total number of observations | 806432 | 9849 | 67194 |
| Number of reflections | 30700 | ||
| <I/σ(I)> | 5.6 | 35.3 | 0.3 |
| Completeness [%] | 99.9 | 100 | 99.4 |
| Redundancy | 26.3 | 19.3 | 27.7 |
| CC(1/2) | 0.997 | 0.998 | 0.293 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | 100 mM Tris, 2.6M sodium formate |
