7G8U
ARHGEF2 PanDDA analysis group deposition -- ARHGEF2 and RhoA in complex with Z131833926
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 | 2022-11-30 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.92124 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 71.379, 71.379, 196.612 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 25.030 - 2.440 |
| R-factor | 0.2273 |
| Rwork | 0.224 |
| R-free | 0.29370 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 8bnt |
| RMSD bond length | 0.007 |
| 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 (14-JUN-2023)) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 35.110 | 35.110 | 2.540 |
| High resolution limit [Å] | 2.440 | 8.800 | 2.440 |
| Rmerge | 0.755 | 0.126 | 5.178 |
| Rmeas | 0.770 | 0.129 | 5.288 |
| Rpim | 0.149 | 0.028 | 1.062 |
| Total number of observations | 514800 | 10465 | 53352 |
| Number of reflections | 19826 | ||
| <I/σ(I)> | 3.3 | 19.2 | 0.4 |
| Completeness [%] | 100.0 | 98.8 | 100 |
| Redundancy | 26 | 20.3 | 24.4 |
| CC(1/2) | 0.984 | 0.998 | 0.295 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | 100 mM Tris, 2.6M sodium formate |
