1U6S
Crystal Structure of the Complex Between Mycobacterium Tuberculosis Beta-Ketoacyl-Acyl Carrier Protein Synthase III and Lauroyl Coenzyme A
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2003-06-23 |
| Detector | RIGAKU RAXIS II |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 |
| Unit cell lengths | 55.570, 63.190, 55.330 |
| Unit cell angles | 113.25, 100.82, 92.66 |
Refinement procedure
| Resolution | 57.740 - 2.300 |
| R-factor | 0.20828 |
| Rwork | 0.206 |
| R-free | 0.24680 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1hzp |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.323 |
| Data reduction software | bioteX |
| Data scaling software | bioteX |
| Phasing software | CNS |
| Refinement software | REFMAC (5.1.24) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 57.700 | 2.400 |
| High resolution limit [Å] | 2.300 | 2.300 |
| Rmerge | 0.073 | 0.260 |
| Number of reflections | 28396 | |
| <I/σ(I)> | 8.7 | 1.9 |
| Completeness [%] | 94.9 | 89.5 |
| Redundancy | 2.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 1.6M ammonium formate, 100 mM Na Hepes buffer, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
