5GG8
Crystal structure of Mycobacterium smegmatis MutT1 in complex with 8-oxo-dGTP, 8-oxo-dGMP and pyrophosphate (II)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM14 |
| Synchrotron site | ESRF |
| Beamline | BM14 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-11-24 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.95372 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 42.050, 84.810, 43.520 |
| Unit cell angles | 90.00, 93.61, 90.00 |
Refinement procedure
| Resolution | 43.430 - 1.850 |
| R-factor | 0.17842 |
| Rwork | 0.176 |
| R-free | 0.22027 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3fjy |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.979 |
| 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] | 43.430 | 1.950 |
| High resolution limit [Å] | 1.850 | 1.850 |
| Number of reflections | 26082 | |
| <I/σ(I)> | 9.5 | 2 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 4.2 | 4.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICROBATCH | 8.5 | 293 | 0.2 M sodium acetate trihydrate, 0.1 M TRIS hydrochloride, pH 8.5, 30% w/v PEG 4000 |
