7G8Q
ARHGEF2 PanDDA analysis group deposition -- ARHGEF2 and RhoA in complex with Z1269220427
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 | 71.177, 71.177, 196.336 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 35.590 - 1.561 |
R-factor | 0.1873 |
Rwork | 0.186 |
R-free | 0.20710 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 8bnt |
RMSD bond length | 0.010 |
RMSD bond angle | 0.920 |
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] | 35.590 | 35.590 | 1.590 |
High resolution limit [Å] | 1.560 | 8.550 | 1.560 |
Rmerge | 0.232 | 0.056 | 5.548 |
Rmeas | 0.237 | 0.058 | 5.692 |
Rpim | 0.046 | 0.013 | 1.248 |
Total number of observations | 1867269 | 10992 | 71912 |
Number of reflections | 72640 | ||
<I/σ(I)> | 9.6 | 49.3 | 0.6 |
Completeness [%] | 99.9 | 99 | 99.5 |
Redundancy | 25.7 | 19.7 | 20.4 |
CC(1/2) | 0.999 | 0.999 | 0.362 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | 100 mM Tris, 2.6M sodium formate |