9CIR
Crystal structure of pyrophosphate-dependent phosphofructokinase from Candidatus Prometheoarchaeum syntrophicum
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-04-30 |
| Detector | DECTRIS EIGER2 S 16M |
| Wavelength(s) | 0.95366 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 85.180, 71.404, 134.868 |
| Unit cell angles | 90.00, 91.12, 90.00 |
Refinement procedure
| Resolution | 49.020 - 2.200 |
| R-factor | 0.2389 |
| Rwork | 0.236 |
| R-free | 0.28960 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.956 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | PHENIX (1.18.2_3874) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.020 | 2.280 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Rmerge | 0.450 | |
| Rmeas | 0.470 | 13.300 |
| Rpim | 0.130 | 3.550 |
| Number of reflections | 82545 | 4539 |
| <I/σ(I)> | 7.1 | |
| Completeness [%] | 99.9 | |
| Redundancy | 7.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 9 | 291 | 1 M MMT pH 9.0, 25 % PEG 1500 |
