7MPM
Bartonella henselae NrnC bound to pAA
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CHESS BEAMLINE F1 |
| Synchrotron site | CHESS |
| Beamline | F1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-10-19 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.0001 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 70.777, 127.472, 128.588 |
| Unit cell angles | 90.00, 95.29, 90.00 |
Refinement procedure
| Resolution | 43.480 - 1.950 |
| R-factor | 0.1455 |
| Rwork | 0.145 |
| R-free | 0.17960 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1yt3 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.760 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.15.2_3472) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.480 | 2.020 |
| High resolution limit [Å] | 1.950 | 1.950 |
| Number of reflections | 165258 | 16396 |
| <I/σ(I)> | 11.98 | |
| Completeness [%] | 99.7 | |
| Redundancy | 3.7 | |
| CC(1/2) | 0.997 | 0.775 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 294 | 0.1 M Succinic acid; 10% PEG 3,350; 20% xylitol |
