4HH6
Peptide from EAEC T6SS Sci1 SciI protein
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 1 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2012-03-16 |
| Detector | PSI PILATUS 6M |
| Wavelength(s) | 0.931 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 40.920, 46.850, 75.530 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 35.980 - 2.500 |
| R-factor | 0.2439 |
| Rwork | 0.242 |
| R-free | 0.26340 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4hh5 |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.360 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | BUSTER (2.11.2) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.560 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.080 | 0.637 |
| Number of reflections | 5360 | |
| <I/σ(I)> | 13.1 | 2.2 |
| Completeness [%] | 99.6 | 98.5 |
| Redundancy | 5.5 | 5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8 | 298 | 20mM Tris, 100mM NaCl, 5%Glyc rol 10mM sodium borate pH 8.5, 1M citrate, protein+peptide 2mg/mL, VAPOR DIFFUSION, SITTING DROP, temperature 298K |
