5CKV
DAHP synthase from Mycobacterium tuberculosis, fully inhibited by tyrosine, phenylalanine, and tryptophan
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2012-11-19 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9724 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 204.760, 204.760, 66.774 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 47.304 - 2.787 |
| R-factor | 0.1774 |
| Rwork | 0.175 |
| R-free | 0.22550 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3nv8 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.773 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.304 | 2.890 |
| High resolution limit [Å] | 2.787 | 2.787 |
| Rmerge | 0.160 | 0.870 |
| Total number of observations | 321302 | |
| Number of reflections | 40049 | |
| <I/σ(I)> | 13.9 | 2.8 |
| Completeness [%] | 99.4 | 94.9 |
| Redundancy | 8 | 7.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.2 | 293 | ammonium sulfate, glycerol, magnesium chloride, TCEP |
