7G8T
ARHGEF2 PanDDA analysis group deposition -- ARHGEF2 and RhoA in complex with Z1273312142
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 | 71.038, 71.038, 196.314 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 20.280 - 1.385 |
| R-factor | 0.1807 |
| Rwork | 0.180 |
| R-free | 0.19830 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 8bnt |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.080 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.7.9) |
| Phasing software | REFMAC |
| Refinement software | BUSTER (2.10.4 (17-FEB-2023)) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 66.800 | 66.800 | 1.460 |
| High resolution limit [Å] | 1.390 | 4.380 | 1.390 |
| Rmerge | 0.116 | 0.038 | 3.015 |
| Rmeas | 0.118 | 0.039 | 3.136 |
| Rpim | 0.024 | 0.008 | 0.846 |
| Total number of observations | 2330382 | 82041 | 195672 |
| Number of reflections | 102976 | ||
| <I/σ(I)> | 16 | 66.1 | 0.8 |
| Completeness [%] | 100.0 | 100 | 99.7 |
| Redundancy | 22.6 | 22.5 | 13.2 |
| CC(1/2) | 1.000 | 1.000 | 0.485 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | 100 mM Tris, 2.6M sodium formate |
