7G8P
ARHGEF2 PanDDA analysis group deposition -- ARHGEF2 and RhoA in complex with Z1269184613
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 | 70.571, 70.571, 197.002 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 33.220 - 2.209 |
| R-factor | 0.2618 |
| Rwork | 0.259 |
| R-free | 0.32400 |
| 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] | 34.720 | 34.720 | 2.280 |
| High resolution limit [Å] | 2.210 | 9.100 | 2.210 |
| Rmerge | 0.434 | 0.080 | |
| Rmeas | 0.443 | 0.082 | 10.987 |
| Rpim | 0.087 | 0.019 | 2.110 |
| Total number of observations | 670575 | 8770 | 58384 |
| Number of reflections | 25945 | ||
| <I/σ(I)> | 4.1 | 31.8 | 0.3 |
| Completeness [%] | 99.9 | 98.6 | 99.1 |
| Redundancy | 25.8 | 19.2 | 26.8 |
| CC(1/2) | 0.996 | 0.998 | 0.342 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | 100 mM Tris, 2.6M sodium formate |
