3AFE
Crystal structure of the HsaA monooxygenase from M.tuberculosis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 HF |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2009-05-15 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 1.541 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 90.968, 94.009, 98.094 |
| Unit cell angles | 90.00, 93.94, 90.00 |
Refinement procedure
| Resolution | 28.797 - 2.500 |
| R-factor | 0.1941 |
| Rwork | 0.191 |
| R-free | 0.25810 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2jbt |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.034 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | PHENIX ((phenix.refine)) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 50.000 |
| High resolution limit [Å] | 2.400 |
| Rmerge | 0.094 |
| Number of reflections | 64589 |
| <I/σ(I)> | 16.2 |
| Completeness [%] | 99.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 296 | 0.1M Tris HCl, 20% w/v PEG 2000 MME, pH 7, VAPOR DIFFUSION, SITTING DROP, temperature 296K |
