6RZR
Structure of IMP-13 metallo-beta-lactamase complexed with hydrolysed imipenem
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06DA |
| Synchrotron site | SLS |
| Beamline | X06DA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-02-11 |
| Detector | DECTRIS PILATUS 2M-F |
| Wavelength(s) | 1 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 48.207, 90.925, 120.811 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 45.500 - 1.900 |
| R-factor | 0.1909 |
| Rwork | 0.189 |
| R-free | 0.22760 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6r79 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.464 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.500 | 1.960 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Number of reflections | 42307 | 4082 |
| <I/σ(I)> | 11.65 | |
| Completeness [%] | 99.2 | |
| Redundancy | 6.6 | |
| CC(1/2) | 0.990 | 0.750 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 298 | 0.1 M Bis-Tris pH 5.5, 0.2 M Ammonium sulfate, 25% PEG 3350 |
