5UWV
Crystal structure of Mycobacterium abscessus L,D-transpeptidase 2
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-03-20 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.97918 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 94.239, 130.937, 135.664 |
| Unit cell angles | 90.00, 92.51, 90.00 |
Refinement procedure
| Resolution | 135.530 - 2.980 |
| R-factor | 0.2008 |
| Rwork | 0.197 |
| R-free | 0.27300 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5du7 |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.676 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Refinement software | REFMAC (5.8.0103) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 135.530 | 3.087 |
| High resolution limit [Å] | 2.980 | 2.980 |
| Rmerge | 0.060 | 0.570 |
| Number of reflections | 65870 | 5838 |
| <I/σ(I)> | 21.02 | 2.52 |
| Completeness [%] | 99.4 | 99.9 |
| Redundancy | 4.6 | 4.8 |
| CC(1/2) | 0.960 | 0.780 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | 13% PEG 8000, 110 mM sodium citrate tribasic dihydrate |
