4NDW
Crystal STRUCTURE OF MYCOBACTERIUM TUBERCULOSIS ESX-1 SECRETED PROTEIN REGULATOR (EspR)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM14 |
| Synchrotron site | ESRF |
| Beamline | BM14 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-04-21 |
| Detector | MAR CCD 225 |
| Wavelength(s) | 0.97833 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 83.890, 83.890, 130.750 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 43.583 - 3.300 |
| R-factor | 0.2683 |
| Rwork | 0.266 |
| R-free | 0.32400 |
| Structure solution method | SAD |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.229 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHENIX (AUTOSOL) |
| Refinement software | PHENIX ((phenix.refine: 1.7.3_928)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.600 | 3.480 |
| High resolution limit [Å] | 3.300 | 3.300 |
| Rmerge | 0.159 | 0.553 |
| Number of reflections | 8435 | |
| <I/σ(I)> | 11 | 2.6 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 11.8 | 12.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 277 | 24% PEG 3350, 0.2M SODIUM MALONATE, 0.1M BIS-TRIS PROPANE, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
