1JJE
IMP-1 METALLO BETA-LACTAMASE FROM PSEUDOMONAS AERUGINOSA IN COMPLEX WITH A BIARYL SUCCINIC ACID INHIBITOR (11)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 17-ID |
| Synchrotron site | APS |
| Beamline | 17-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 1999-06-22 |
| Detector | MARRESEARCH |
| Wavelength(s) | 1.00 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 71.440, 43.240, 64.230 |
| Unit cell angles | 90.00, 100.93, 90.00 |
Refinement procedure
| Resolution | 10.000 - 1.800 |
| R-factor | 0.201 |
| Rwork | 0.201 |
| R-free | 0.29100 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | ANOTHER INHIBITED COMPLEX IN THE SAME SPACE GROUP |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.023 |
| Data reduction software | X-GEN |
| Data scaling software | X-GEN |
| Refinement software | SHELXL-97 |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 9999.000 * | 1.910 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.075 | 0.500 |
| Number of reflections | 35791 | 5910 * |
| <I/σ(I)> | 13.005 | 1.336 |
| Completeness [%] | 99.7 | 100 |
| Redundancy | 3.59 | 3.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.2 * | 37 * | PEG MONOMETHYL ETHER 550, ZINC ACETATE, MES PH 6.7-7.1, 310 K, pH 6.9, VAPOR DIFFUSION, HANGING DROP, temperature 310K |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | protein | 10 (mg/ml) | |
| 2 | 1 | drop | Tris | 10 (mM) | |
| 3 | 1 | drop | dithiothreitol | 2 (mM) | |
| 4 | 1 | drop | beta-octylglucoside | 0.1 (%) | |
| 5 | 1 | reservoir | PEG550 | 25-32 (%) | |
| 6 | 1 | reservoir | zinc acetate | 2 (mM) | |
| 7 | 1 | reservoir | MES | 100 (mM) |
