5U23
X-ray structure of the WlaRG aminotransferase from Campylobacter jejuni in complex with TDP-Qui3N
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU200 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2016-09-02 |
| Detector | Bruker Platinum 135 |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 107.824, 56.644, 124.549 |
| Unit cell angles | 90.00, 90.01, 90.00 |
Refinement procedure
| Resolution | 29.920 - 1.450 |
| R-factor | 0.12853 |
| Rwork | 0.127 |
| R-free | 0.15340 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2u1z |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.731 |
| Data reduction software | SAINT |
| Data scaling software | SADABS |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0124) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.550 |
| High resolution limit [Å] | 1.450 | 1.450 |
| Rmerge | 0.076 | 0.370 |
| Number of reflections | 261560 | |
| <I/σ(I)> | 9 | 1.9 |
| Completeness [%] | 98.2 | 93.8 |
| Redundancy | 3.2 | 2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | 100 mM MOPS (pH 7) 12-15% PEG3350 10 mM TDP-Qui3N 1 mM PLP |
