4ODP
Structure of SlyD delta-IF from Thermus thermophilus in complex with S2-W23A peptide
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I24 |
| Synchrotron site | Diamond |
| Beamline | I24 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-07-07 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.4000 |
| Spacegroup name | P 41 3 2 |
| Unit cell lengths | 93.690, 93.690, 93.690 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 29.627 - 1.747 |
| R-factor | 0.1849 |
| Rwork | 0.184 |
| R-free | 0.20180 |
| Structure solution method | SAD |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.258 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHENIX (AutoSol) |
| Refinement software | PHENIX ((phenix.refine: 1.8.2_1309)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 29.627 | 1.790 |
| High resolution limit [Å] | 1.747 | 1.747 |
| Number of reflections | 14816 | |
| <I/σ(I)> | 35.85 | 3.6 |
| Completeness [%] | 100.0 | 99.9 |
| Redundancy | 17.6 | 16.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 277 | 28% PEG400, 0.1 M HEPES, pH 7.5, 0.2 M calcium chloride, VAPOR DIFFUSION, SITTING DROP, temperature 277K |
