6EUP
Crystal structure of Neisseria meningitidis NadA variant 3 double mutant A33I-I38L
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE MASSIF-1 |
| Synchrotron site | ESRF |
| Beamline | MASSIF-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-10-08 |
| Detector | DECTRIS PILATUS3 2M |
| Wavelength(s) | 0.966 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 68.919, 39.750, 255.630 |
| Unit cell angles | 90.00, 95.13, 90.00 |
Refinement procedure
| Resolution | 63.650 - 2.650 |
| R-factor | 0.2 |
| Rwork | 0.198 |
| R-free | 0.23600 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.140 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | BUSTER (2.10.2) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 63.650 | 2.790 |
| High resolution limit [Å] | 2.650 | 2.650 |
| Rmerge | 0.080 | 0.401 |
| Rmeas | 0.098 | 0.494 |
| Number of reflections | 18251 | 2415 |
| <I/σ(I)> | 8 | 2.2 |
| Completeness [%] | 89.1 | 84.4 |
| Redundancy | 2.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.1 M sodium phosphate citrate pH 3.9, 5% (w/v) PEG 1K, 33.6-45.9% (v/v) MPD |
