3RAZ
The crystal structure of thioredoxin-related protein from Neisseria meningitidis serogroup B
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X29A |
| Synchrotron site | NSLS |
| Beamline | X29A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-03-04 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.9795 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 48.443, 69.033, 45.032 |
| Unit cell angles | 90.00, 104.93, 90.00 |
Refinement procedure
| Resolution | 43.510 - 2.000 |
| R-factor | 0.2335 |
| Rwork | 0.231 |
| R-free | 0.27520 |
| Structure solution method | SAD |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.188 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | SOLVE |
| Refinement software | PHENIX ((phenix.refine)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.510 | 2.110 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.039 | 0.171 |
| Number of reflections | 9567 | |
| <I/σ(I)> | 26.9 | 7.6 |
| Completeness [%] | 98.2 | 94.2 |
| Redundancy | 7.2 | 6.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 277 | 0.1 M Tris-HCl pH 8.5, 30% PEG 4K, 2.4 M lithium sulfate, VAPOR DIFFUSION, SITTING DROP, temperature 277K |
