7G8L
ARHGEF2 PanDDA analysis group deposition -- ARHGEF2 and RhoA in complex with Z1251207602
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 | 71.316, 71.316, 196.273 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 23.200 - 1.600 |
| R-factor | 0.1995 |
| Rwork | 0.198 |
| R-free | 0.22850 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 8bnt |
| RMSD bond length | 0.010 |
| RMSD bond angle | 0.900 |
| 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] | 67.050 | 67.050 | 1.630 |
| High resolution limit [Å] | 1.600 | 8.770 | 1.600 |
| Rmerge | 0.386 | 0.076 | |
| Rmeas | 0.394 | 0.078 | 10.461 |
| Rpim | 0.077 | 0.017 | 2.240 |
| Total number of observations | 1762341 | 10172 | 71836 |
| Number of reflections | 67900 | ||
| <I/σ(I)> | 7.2 | 37.8 | 0.4 |
| Completeness [%] | 100.0 | 100 | 100 |
| Redundancy | 26 | 19 | 21.6 |
| CC(1/2) | 0.997 | 0.995 | 0.322 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | 100 mM Tris, 2.6M sodium formate |
