6V40
Structure of Salmonella Typhi TtsA
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS-II BEAMLINE 17-ID-1 |
Synchrotron site | NSLS-II |
Beamline | 17-ID-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-06-08 |
Detector | DECTRIS EIGER X 9M |
Wavelength(s) | 0.97936 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 136.985, 138.607, 135.199 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 43.370 - 2.104 |
R-factor | 0.1928 |
Rwork | 0.191 |
R-free | 0.22150 |
Structure solution method | SAD |
RMSD bond length | 0.013 |
RMSD bond angle | 1.712 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 43.410 | 2.179 |
High resolution limit [Å] | 2.100 | 2.104 |
Rmerge | 0.068 | 0.964 |
Number of reflections | 73442 | 6414 |
<I/σ(I)> | 22.37 | 1.31 |
Completeness [%] | 98.3 | |
Redundancy | 4.9 | |
CC(1/2) | 0.891 | 0.462 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.1 M sodium citrate pH 5.8, 0.1 m NaCl, and 18% v/v (+/-)-2-methyl-2,4-pentanediol |