9G5F
The structure of Aspergillus fumigatus UDP-GlcNAc pyrophosphorylase in complex with a fragment
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-10-09 |
| Detector | DECTRIS EIGER2 XE 16M |
| Wavelength(s) | 0.98 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 56.430, 139.780, 144.190 |
| Unit cell angles | 90.00, 90.04, 90.00 |
Refinement procedure
| Resolution | 52.330 - 1.620 |
| R-factor | 0.21104 |
| Rwork | 0.209 |
| R-free | 0.24652 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.521 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0352) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 52.330 | 1.650 |
| High resolution limit [Å] | 1.620 | 1.620 |
| Number of reflections | 239403 | 4911 |
| <I/σ(I)> | 18.7 | |
| Completeness [%] | 84.7 | |
| Redundancy | 6.3 | |
| CC(1/2) | 1.000 | 0.319 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 291 | 0.2 M Sodium acetate 25 % PEG3350 |
