9QL9
CA domain of LvrB from Leptospira in its apo form
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-02-04 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 1.000039 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 41.543, 57.153, 135.448 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 43.680 - 1.500 |
| R-factor | 0.1975 |
| Rwork | 0.195 |
| R-free | 0.23710 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.332 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.21.2_5419) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.680 | 1.550 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Rmerge | 0.045 | 1.526 |
| Rmeas | 0.046 | |
| Rpim | 0.013 | 0.427 |
| Number of reflections | 691258 | 5150 |
| <I/σ(I)> | 25.3 | 2.01 |
| Completeness [%] | 99.7 | 99.1 |
| Redundancy | 13.2 | 13.7 |
| CC(1/2) | 1.000 | 0.932 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 298 | 50 mM Tris, 100 mM MgCl2, 15% PEG 4000 |
