8TV3
Fab 221-5 in complex with OspA
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-E |
Synchrotron site | APS |
Beamline | 24-ID-E |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-02-14 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.979 |
Spacegroup name | P 21 2 21 |
Unit cell lengths | 63.819, 90.963, 211.962 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 46.859 - 2.312 |
R-factor | 0.2008 |
Rwork | 0.199 |
R-free | 0.22730 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.005 |
RMSD bond angle | 0.765 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX ((1.11.1_2575: ???)) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.340 |
High resolution limit [Å] | 2.300 | 6.240 | 2.300 |
Rmerge | 0.047 | 0.828 | |
Rmeas | 0.053 | 0.970 | |
Rpim | 0.024 | 0.495 | |
Number of reflections | 53784 | 2922 | 2629 |
<I/σ(I)> | 5.2 | ||
Completeness [%] | 98.4 | 98 | 96.8 |
Redundancy | 4.4 | 4.4 | 3.3 |
CC(1/2) | 0.630 | 0.997 | 0.631 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 277 | 100 mM MES pH 6.5, 30% PEG 600, 5% PEG 1000, and 10% glycerol. |