7VQC
Structure of MA1831 from Methanosarcina acetivorans in complex with pyrophosphate
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | LIQUID ANODE |
| Source details | BRUKER METALJET |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-04-14 |
| Detector | Bruker PHOTON III |
| Wavelength(s) | 1.34138 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 111.025, 82.129, 59.809 |
| Unit cell angles | 90.00, 102.97, 90.00 |
Refinement procedure
| Resolution | 33.000 - 2.450 |
| R-factor | 0.174 |
| Rwork | 0.170 |
| R-free | 0.25200 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 7caq |
| Data reduction software | SAINT |
| Data scaling software | Aimless (0.6.3) |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 33.000 | 2.370 |
| High resolution limit [Å] | 2.290 | 2.290 |
| Rmerge | 0.188 | 0.831 |
| Number of reflections | 19356 | 2085 |
| <I/σ(I)> | 7.9 | |
| Completeness [%] | 99.0 | 90.7 |
| Redundancy | 6.2 | 4.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8 | 298 | 1.5M ammonium sulfate, 0.1M Tris (pH 8.0), 12% glycerol |
