4QQ1
Crystal structure of the isotype 1 Transferrin binding protein B (TbpB) from serogroup B Neisseria meningitidis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CLSI BEAMLINE 08B1-1 |
| Synchrotron site | CLSI |
| Beamline | 08B1-1 |
| Temperature [K] | 50 |
| Detector technology | CCD |
| Collection date | 2012-09-26 |
| Detector | RAYONIX MX300HE |
| Wavelength(s) | 1.00 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 135.330, 99.971, 160.157 |
| Unit cell angles | 90.00, 93.47, 90.00 |
Refinement procedure
| Resolution | 45.167 - 3.330 |
| R-factor | 0.2516 |
| Rwork | 0.249 |
| R-free | 0.30120 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.984 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER (2.3.0) |
| Refinement software | PHENIX (1.8.2_1309) |
Data quality characteristics
| Overall | Inner shell | |
| Low resolution limit [Å] | 50.000 | 50.000 |
| High resolution limit [Å] | 3.330 | 8.210 |
| Rmerge | 0.100 | 0.044 |
| Number of reflections | 60615 | |
| <I/σ(I)> | 8.6 | |
| Completeness [%] | 98.7 | 99.5 |
| Redundancy | 7.4 | 7.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.8 | 275 | 0.2M cesium chloride, sodium citrate pH 5.8, 1.8M ammonium sulfate, 15% glycerol, vapor diffusion, hanging drop, temperature 275K |
