5TQU
Trypanosoma brucei methionyl-tRNA synthetase in complex with inhibitor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL12-2 |
Synchrotron site | SSRL |
Beamline | BL12-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-07-27 |
Detector | PSI PILATUS 6M |
Wavelength(s) | 0.98 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 87.960, 106.320, 207.590 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 103.790 - 2.600 |
R-factor | 0.21423 |
Rwork | 0.213 |
R-free | 0.24122 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4mw0 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.342 |
Data reduction software | HKL-2000 |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 103.790 | 2.670 |
High resolution limit [Å] | 2.600 | 2.600 |
Number of reflections | 60480 | |
<I/σ(I)> | 5.5 | |
Completeness [%] | 99.7 | |
Redundancy | 5.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 298 | 1.8-2.1 M AMMONIUM SULFATE, 0.2 M SODIUM CHLORIDE, 0.1 M SODIUM CACODYLATE, PH 6.2-6.8, VAPOR DIFFUSION, SITTING DROP, TEMPERATURE 298K |