6BU2
Crystal structure of methylmalonyl-CoA epimerase from Mycobacterium tuberculosis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 120 |
| Detector technology | CCD |
| Collection date | 2015-04-22 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 46.379, 51.525, 53.620 |
| Unit cell angles | 90.00, 105.66, 90.00 |
Refinement procedure
| Resolution | 44.659 - 1.997 |
| R-factor | 0.1891 |
| Rwork | 0.187 |
| R-free | 0.23340 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1jc5 |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.897 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.10.1_2155) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.660 | 2.030 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.046 | 0.158 |
| Number of reflections | 16637 | 827 |
| <I/σ(I)> | 16.5 | |
| Completeness [%] | 99.6 | 99.5 |
| Redundancy | 5.7 | 5.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 289 | 1.5 M Ammonium sulfate, 0.1 M BIS-TRIS propane pH 7.0 |
