9HKB
Crystal structure of IMPDH from Burkholderia thailandensis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 2 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-10-14 |
| Detector | DECTRIS EIGER X 9M |
| Wavelength(s) | 0.826561 |
| Spacegroup name | P 4 |
| Unit cell lengths | 91.510, 91.510, 86.320 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 45.760 - 1.440 |
| R-factor | 0.1612 |
| Rwork | 0.160 |
| R-free | 0.17470 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.317 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.760 | 1.494 |
| High resolution limit [Å] | 1.440 | 1.440 |
| Number of reflections | 1773187 | 176568 |
| <I/σ(I)> | 16 | |
| Completeness [%] | 99.7 | |
| Redundancy | 13.9 | |
| CC(1/2) | 1.000 | 0.866 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 4.2 | 291.15 | 10%w/v PEG 3K, 0.1 M NaPhosCit 4.2 pH, 0.2 M NaCl |
