5GGC
Crystal structure of Mycobacterium smegmatis MutT1 in complex with phosphate and magnesium ions (excess magnesium, 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 | 2014-08-01 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 1.54179 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 38.990, 87.670, 90.680 |
| Unit cell angles | 90.00, 99.93, 90.00 |
Refinement procedure
| Resolution | 31.970 - 1.850 |
| R-factor | 0.22481 |
| Rwork | 0.223 |
| R-free | 0.26724 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3fjy |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.727 |
| 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] | 31.970 | 1.950 |
| High resolution limit [Å] | 1.850 | 1.850 |
| Number of reflections | 51169 | |
| <I/σ(I)> | 7.6 | 1.9 |
| Completeness [%] | 99.8 | 99.3 |
| Redundancy | 5.3 | 5.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICROBATCH | 8.5 | 293 | 0.2 M magnesium chloride hexahydrate, 0.1 M TRIS hydrochloride, 30% w/v PEG 4000 |
