9SQE
PaMurU in complex with Mg2+ cofactor and UDPNAM/Diphosphate products
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALBA BEAMLINE XALOC |
| Synchrotron site | ALBA |
| Beamline | XALOC |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2025-05-03 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97926 |
| Spacegroup name | P 1 |
| Unit cell lengths | 51.706, 51.719, 72.834 |
| Unit cell angles | 90.53, 90.54, 102.57 |
Refinement procedure
| Resolution | 41.749 - 2.200 |
| Rwork | 0.155 |
| R-free | 0.20500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.642 |
| Data reduction software | XDS (1.20) |
| Data scaling software | Aimless (0.7.15) |
| Phasing software | PHASER (2.8.3) |
| Refinement software | REFMAC (5.8.0425) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 51.940 | 2.160 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Number of reflections | 40882 | 3225 |
| <I/σ(I)> | 8.3 | |
| Completeness [%] | 93.8 | |
| Redundancy | 3.5 | |
| CC(1/2) | 0.978 | 0.708 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 291 | HEPES 0.1M pH=7.5, 0.2M NaCl 25% PEG3350 |
