8WEX
Crystal structure of N-acetyl sugar amidotransferase from Legionella pneumophila
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U |
Synchrotron site | SSRF |
Beamline | BL17U |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2016-10-29 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.97914 |
Spacegroup name | P 32 1 2 |
Unit cell lengths | 74.722, 74.722, 319.678 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 20.000 - 2.330 |
R-factor | 0.20986 |
Rwork | 0.208 |
R-free | 0.24687 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 1.234 |
Data reduction software | autoPX |
Data scaling software | pointless |
Phasing software | MR-Rosetta |
Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.670 | 2.390 |
High resolution limit [Å] | 2.330 | 2.330 |
Number of reflections | 44179 | 3210 |
<I/σ(I)> | 19.8 | |
Completeness [%] | 100.0 | |
Redundancy | 17.2 | |
CC(1/2) | 0.998 | 0.602 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 287 | 20% (w/v) PEG 3350, 0.2 M ammonium acetate |