7FLT
PanDDA analysis group deposition -- Aar2/RNaseH in complex with fragment P05G04 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 | 2020-05-15 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.999900 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 87.839, 81.784, 93.475 |
Unit cell angles | 90.00, 107.98, 90.00 |
Refinement procedure
Resolution | 43.300 - 1.730 |
R-factor | 0.2609 |
Rwork | 0.259 |
R-free | 0.30500 |
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] | 43.300 | 43.300 | 43.300 |
High resolution limit [Å] | 1.730 | 5.150 | 1.730 |
Rmerge | 0.044 | 3.095 | |
Rmeas | 0.087 | 0.048 | 3.360 |
Total number of observations | 435732 | 17406 | 62265 |
Number of reflections | 64698 | 2571 | 9510 |
<I/σ(I)> | 10.3 | 34.89 | 0.56 |
Completeness [%] | 97.8 | 99.5 | 89.3 |
Redundancy | 6.73 | 6.77 | 6.55 |
CC(1/2) | 0.998 | 0.998 | 0.321 |
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 |