7G8Z
ARHGEF2 PanDDA analysis group deposition -- ARHGEF2 and RhoA in complex with Z1493056027
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 | 71.130, 71.130, 196.377 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 22.060 - 1.509 |
R-factor | 0.1949 |
Rwork | 0.194 |
R-free | 0.22070 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 8bnt |
RMSD bond length | 0.011 |
RMSD bond angle | 0.950 |
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] | 71.150 | 71.150 | 1.540 |
High resolution limit [Å] | 1.510 | 8.270 | 1.510 |
Rmerge | 0.259 | 0.053 | 5.244 |
Rmeas | 0.264 | 0.054 | 5.392 |
Rpim | 0.052 | 0.012 | 1.235 |
Total number of observations | 2009339 | 12374 | 72002 |
Number of reflections | 80253 | ||
<I/σ(I)> | 7.6 | 48.5 | 0.4 |
Completeness [%] | 100.0 | 100 | 99.3 |
Redundancy | 25 | 19.9 | 18.6 |
CC(1/2) | 0.998 | 0.999 | 0.406 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | 100 mM Tris, 2.6M sodium formate |