7FOF
PanDDA analysis group deposition -- Aar2/RNaseH in complex with fragment P08A10 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 | 2020-06-12 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.999900 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 88.047, 82.056, 93.109 |
Unit cell angles | 90.00, 107.84, 90.00 |
Refinement procedure
Resolution | 41.030 - 1.770 |
R-factor | 0.2458 |
Rwork | 0.244 |
R-free | 0.28980 |
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] | 41.030 | 41.030 | 41.030 |
High resolution limit [Å] | 1.770 | 5.270 | 1.770 |
Rmerge | 0.030 | 2.153 | |
Rmeas | 0.060 | 0.033 | 2.332 |
Total number of observations | 428319 | 16404 | 65993 |
Number of reflections | 61581 | 2406 | 9802 |
<I/σ(I)> | 15.11 | 56.45 | 0.65 |
Completeness [%] | 99.7 | 99.3 | 98.5 |
Redundancy | 6.96 | 6.82 | 6.73 |
CC(1/2) | 0.999 | 0.999 | 0.351 |
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 |