1VS0
Crystal Structure of the Ligase Domain from M. tuberculosis LigD at 2.4A
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.3.1 |
| Synchrotron site | ALS |
| Beamline | 8.3.1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2004-09-23 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.9796, 1.020, 0.9798 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 57.102, 57.102, 368.957 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 50.000 - 2.400 |
| R-factor | 0.195 |
| Rwork | 0.192 |
| R-free | 0.24800 |
| Structure solution method | MAD |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.600 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | SOLVE |
| Refinement software | REFMAC (5.2) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.490 |
| High resolution limit [Å] | 2.400 | 2.400 |
| Number of reflections | 28772 | |
| <I/σ(I)> | 18.8 | 2.9 |
| Completeness [%] | 99.5 | 96.2 |
| Redundancy | 5.3 | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 294 | 6% PEG 3000, 25 mM ZnCl2, 100 mM sodium acetate (pH 4.6), VAPOR DIFFUSION, HANGING DROP, temperature 294K |
