7WPT
Methionyl-tRNA synthetase from Staphylococcus aureus complexed with a fragment M2-80 and ATP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL02U1 |
Synchrotron site | SSRF |
Beamline | BL02U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-12-01 |
Detector | DECTRIS EIGER2 S 9M |
Wavelength(s) | 0.97914 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 60.993, 76.536, 118.642 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 64.310 - 2.260 |
R-factor | 0.2236 |
Rwork | 0.221 |
R-free | 0.26730 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 7wpm |
RMSD bond length | 0.003 |
RMSD bond angle | 1.213 |
Data reduction software | autoPROC |
Data scaling software | XSCALE |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0232) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 64.310 | 2.409 |
High resolution limit [Å] | 2.260 | 2.260 |
Rmerge | 0.070 | 0.540 |
Number of reflections | 24773 | 4141 |
<I/σ(I)> | 12.2 | 3 |
Completeness [%] | 93.2 | 98.1 |
Redundancy | 3.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 300 | Sodium cacodylate, PEG 3350 |