9UVK
Crystal structure of UMPK from S. aureus in complex with GTP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | Cu FINE FOCUS |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-05-03 |
| Detector | DECTRIS PILATUS 200K |
| Wavelength(s) | 1.5406 |
| Spacegroup name | P 32 |
| Unit cell lengths | 194.263, 194.263, 116.778 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 13.142 - 2.880 |
| R-factor | 0.205755538349 |
| Rwork | 0.203 |
| R-free | 0.25704 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.515 |
| Data reduction software | CrysalisPro |
| Data scaling software | Aimless |
| Phasing software | PHASER (1.11.1_2575) |
| Refinement software | PHENIX (1.11.1_2575) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 13.142 | 2.980 |
| High resolution limit [Å] | 2.880 | 2.880 |
| Rmerge | 0.758 | |
| Number of reflections | 110376 | 5532 |
| <I/σ(I)> | 8.7 | |
| Completeness [%] | 98.9 | |
| Redundancy | 4.1 | |
| CC(1/2) | 0.991 | 0.688 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 289.15 | 0.7 M Ammonium tartrate dibasic, 0.1 M Tris pH8.5 |
