7G80
ARHGEF2 PanDDA analysis group deposition -- ARHGEF2 and RhoA in complex with Z1041785508
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 | 2022-10-05 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.92124 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 71.607, 71.607, 197.037 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 35.800 - 1.671 |
| R-factor | 0.2045 |
| Rwork | 0.203 |
| R-free | 0.23010 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 8bnt |
| RMSD bond length | 0.010 |
| RMSD bond angle | 0.880 |
| 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] | 35.800 | 35.800 | 1.700 |
| High resolution limit [Å] | 1.670 | 9.000 | 1.670 |
| Rmerge | 0.264 | 0.045 | 7.424 |
| Rmeas | 0.269 | 0.046 | 7.574 |
| Rpim | 0.052 | 0.010 | 1.486 |
| Total number of observations | 1608590 | 9349 | 76533 |
| Number of reflections | 60466 | ||
| <I/σ(I)> | 8.4 | 55.1 | 0.4 |
| Completeness [%] | 99.9 | 98.9 | 98.5 |
| Redundancy | 26.6 | 19.1 | 25.5 |
| CC(1/2) | 0.999 | 0.999 | 0.497 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | 100 mM Tris, 2.6M sodium formate |
