3FVE
Crystal structure of diaminopimelate epimerase Mycobacterium tuberculosis DapF
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-09-27 |
| Detector | ADSC QUANTUM Q315r |
| Wavelength(s) | 0.976 |
| Spacegroup name | P 65 2 2 |
| Unit cell lengths | 183.640, 183.640, 45.210 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 45.000 - 2.600 |
| R-factor | 0.226 |
| Rwork | 0.224 |
| R-free | 0.25400 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1bwz |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.362 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.220 | 2.730 |
| High resolution limit [Å] | 2.590 | 2.590 |
| Rmerge | 0.086 | 0.758 |
| Number of reflections | 14430 | |
| <I/σ(I)> | 3.8 | |
| Completeness [%] | 99.7 | 98.4 |
| Redundancy | 13.2 | 13 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 9.5 | 291 | 1.9 M (NH4)H2PO4, 0.1 M bis-tris propane, pH 9.5, 2.5% glycerol, vapor diffusion, temperature 291K, VAPOR DIFFUSION |
