3L2Z
Crystal structure of hydrated Biotin Protein Ligase from M. tuberculosis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | EMBL/DESY, HAMBURG BEAMLINE X13 |
| Synchrotron site | EMBL/DESY, HAMBURG |
| Beamline | X13 |
| Temperature [K] | 295 |
| Detector technology | CCD |
| Collection date | 2007-02-21 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 0.8088 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 79.693, 62.772, 105.752 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 14.126 - 2.800 |
| R-factor | 0.1798 |
| Rwork | 0.174 |
| R-free | 0.23100 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2cgh |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.036 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((phenix.refine)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 15.000 | 2.900 |
| High resolution limit [Å] | 2.800 | 2.800 |
| Rmerge | 0.098 | 0.462 |
| Number of reflections | 15831 | |
| <I/σ(I)> | 17.2 | 2.2 |
| Completeness [%] | 99.4 | 99.6 |
| Redundancy | 5.7 | 5.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 7.5 | 293 | 12-16% PEG4000, PEG8000, 0.1M HEPES, pH 7.5, VAPOR DIFFUSION, temperature 293K |
