7FOH
PanDDA analysis group deposition -- Aar2/RNaseH in complex with fragment P08B05 from the F2X-Universal Library
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | MAX IV BEAMLINE BioMAX |
Synchrotron site | MAX IV |
Beamline | BioMAX |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2020-05-03 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.999900 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 89.397, 81.783, 93.429 |
Unit cell angles | 90.00, 108.60, 90.00 |
Refinement procedure
Resolution | 44.270 - 1.690 |
R-factor | 0.2981 |
Rwork | 0.297 |
R-free | 0.33600 |
Structure solution method | FOURIER SYNTHESIS |
Data reduction software | XDS (Jan 10, 2022) |
Data scaling software | Aimless |
Phasing software | PHENIX (1.17.1_3660) |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 44.270 | 44.270 | 44.270 |
High resolution limit [Å] | 1.690 | 5.030 | 1.690 |
Rmerge | 0.048 | 3.222 | |
Rmeas | 0.088 | 0.052 | 3.487 |
Total number of observations | 464033 | 17651 | 67403 |
Number of reflections | 68938 | 2760 | 10031 |
<I/σ(I)> | 9.63 | 34.63 | 0.3 |
Completeness [%] | 95.9 | 98.9 | 86.7 |
Redundancy | 6.73 | 6.4 | 6.72 |
CC(1/2) | 0.998 | 0.996 | 0.220 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | 19% PEG4000, 3% DMSO, 0.1 M Tris, pH 8.5, 0.2 M lithium sulfate |