7UO8
Co-crystal structure of Salmonella Typhimurium Tlde1a in complex with D-methionine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CLSI BEAMLINE 08B1-1 |
Synchrotron site | CLSI |
Beamline | 08B1-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-04-22 |
Detector | DECTRIS PILATUS3 S 6M |
Wavelength(s) | 1.1806 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 59.461, 59.461, 106.796 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 42.050 - 1.600 |
R-factor | 0.1959 |
Rwork | 0.189 |
R-free | 0.21060 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 7uma |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 42.050 | 1.660 |
High resolution limit [Å] | 1.600 | 1.600 |
Rmerge | 0.062 | 0.449 |
Number of reflections | 26027 | 2538 |
<I/σ(I)> | 23.9 | |
Completeness [%] | 99.3 | 99.8 |
Redundancy | 13.1 | |
CC(1/2) | 0.999 | 0.961 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 277.15 | 12mg/ml Tlde1a, 15% PEG 3350, 0.2M Ammonium sulphate, Soaked with 161mM D-methionine for 2 mins 30 secs |