9CSE
Crystal structure of Repeats-in-Toxin-like domain from Aeromonas hydrophila
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CLSI BEAMLINE 08ID-1 |
| Synchrotron site | CLSI |
| Beamline | 08ID-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-03-14 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 1.53484 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 67.603, 103.327, 95.710 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.750 - 1.950 |
| R-factor | 0.20587 |
| Rwork | 0.203 |
| R-free | 0.25750 |
| Structure solution method | SAD |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.596 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | AutoSol |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.000 |
| High resolution limit [Å] | 1.950 | 1.950 |
| Rmerge | 0.127 | 1.657 |
| Rmeas | 0.132 | |
| Rpim | 0.037 | 0.675 |
| Number of reflections | 24829 | 1739 |
| <I/σ(I)> | 15.9 | 2 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 12.9 | 12.9 |
| CC(1/2) | 0.999 | 0.730 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6 | 295 | PEG 8000, MES, Acetate calcium |
