8TVJ
Fab 227-1 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 | I 41 2 2 |
Unit cell lengths | 109.578, 109.578, 316.123 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.426 - 3.168 |
R-factor | 0.2385 |
Rwork | 0.235 |
R-free | 0.29530 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.002 |
RMSD bond angle | 0.569 |
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 | 3.200 |
High resolution limit [Å] | 3.150 | 8.540 | 3.150 |
Rmerge | 0.073 | 1.679 | |
Rmeas | 0.083 | 1.837 | |
Rpim | 0.037 | 0.732 | |
Number of reflections | 16722 | 909 | 839 |
<I/σ(I)> | 3.5 | ||
Completeness [%] | 99.0 | 95.2 | 99.9 |
Redundancy | 5.7 | 4.6 | 6 |
CC(1/2) | 0.470 | 0.991 | 0.473 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 277 | 2.0 M triammonium citrate and 5% MPD. |