2WRS
Crystal Structure of the Mono-Zinc Metallo-beta-lactamase VIM-4 from Pseudomonas aeruginosa
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-2 |
| Synchrotron site | ESRF |
| Beamline | ID14-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-06-14 |
| Detector | ADSC CCD |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 140.130, 45.670, 105.030 |
| Unit cell angles | 90.00, 105.41, 90.00 |
Refinement procedure
| Resolution | 43.270 - 2.790 |
| R-factor | 0.20134 |
| Rwork | 0.199 |
| R-free | 0.25318 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2whg |
| RMSD bond length | 0.019 |
| RMSD bond angle | 1.794 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0072) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.960 |
| High resolution limit [Å] | 2.750 | 2.790 |
| Rmerge | 0.080 | 0.390 |
| Number of reflections | 16118 | |
| <I/σ(I)> | 14.03 | 3.43 |
| Completeness [%] | 98.8 | 96.2 |
| Redundancy | 3.6 | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7 | 1.55 M AMMONIUM CITRATE TRIBASIC PH 7.0 POWDER OF COMPOUND 18 IN THE DROP. |
