5U21
X-ray structure of the WlaRF aminotransferase from Campylobacter jejuni, K184A mutant 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 | 2016-08-21 |
| Detector | Bruker Platinum 135 |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 108.164, 56.653, 124.802 |
| Unit cell angles | 90.00, 90.04, 90.00 |
Refinement procedure
| Resolution | 29.980 - 1.600 |
| R-factor | 0.13369 |
| Rwork | 0.132 |
| R-free | 0.16132 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5u1z |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.829 |
| 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 | 1.700 |
| High resolution limit [Å] | 1.600 | 1.600 |
| Rmerge | 0.065 | 0.303 |
| Number of reflections | 194888 | |
| <I/σ(I)> | 10.2 | 1.9 |
| Completeness [%] | 97.6 | 92.7 |
| Redundancy | 3 | 1.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | 100 mM MOPS (pH 7) 12-15% PEG-3350 1 mM PLP 10 mM TDP-Qui3N |
