5XD3
Crystal structure of Mycobacterium smegmatis MutT1 in complex with ATP (I)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | BRUKER AXS MICROSTAR |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2016-04-13 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 1.54179 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 42.030, 84.210, 43.790 |
| Unit cell angles | 90.00, 92.89, 90.00 |
Refinement procedure
| Resolution | 38.810 - 1.780 |
| R-factor | 0.16428 |
| Rwork | 0.162 |
| R-free | 0.20447 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5gg5 |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.888 |
| Data reduction software | iMOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 38.810 | 1.880 |
| High resolution limit [Å] | 1.780 | 1.780 |
| Number of reflections | 28450 | 4037 |
| <I/σ(I)> | 12.9 | 1.8 |
| Completeness [%] | 97.3 | 94.9 |
| Redundancy | 5 | 5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICROBATCH | 8.5 | 293 | 0.2M sodium acetate trihydrate, 0.1M Tris-HCl pH 8.5, 30%(w/v) PEG4000 |
