7G8W
ARHGEF2 PanDDA analysis group deposition -- ARHGEF2 and RhoA in complex with Z1416193393
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 | 71.430, 71.430, 196.336 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 67.130 - 1.939 |
R-factor | 0.2103 |
Rwork | 0.208 |
R-free | 0.25040 |
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] | 71.430 | 71.430 | 1.980 |
High resolution limit [Å] | 1.940 | 9.090 | 1.940 |
Rmerge | 0.780 | 0.092 | 8.530 |
Rmeas | 0.795 | 0.094 | 8.688 |
Rpim | 0.153 | 0.021 | 1.638 |
Total number of observations | 1031338 | 9282 | 70906 |
Number of reflections | 38770 | ||
<I/σ(I)> | 4.5 | 26.9 | 0.5 |
Completeness [%] | 99.9 | 100 | 98.9 |
Redundancy | 26.6 | 19.3 | 28 |
CC(1/2) | 0.990 | 0.998 | 0.371 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | 100 mM Tris, 2.6M sodium formate |