5DL1
ClpP from Staphylococcus aureus in complex with AV145
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-11-30 |
| Detector | PSI PILATUS 6M |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 112.820, 97.750, 131.950 |
| Unit cell angles | 90.00, 95.49, 90.00 |
Refinement procedure
| Resolution | 15.000 - 3.000 |
| R-factor | 0.25273 |
| Rwork | 0.252 |
| R-free | 0.27409 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3v5e |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.893 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 3.100 |
| High resolution limit [Å] | 3.000 | 3.000 |
| Rmerge | 0.058 | 0.610 |
| Number of reflections | 56975 | |
| <I/σ(I)> | 14.1 | 2.2 |
| Completeness [%] | 99.1 | 99.9 |
| Redundancy | 3.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | 200 mM KNO3, 20% PEG3350 |
