2QIN
Stenotrophomonas maltophilia L1 Metallo-beta-Lactamase Asp-120 Cys mutant
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SRS BEAMLINE PX14.1 |
| Synchrotron site | SRS |
| Beamline | PX14.1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2003-09-09 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 1.488 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 66.141, 112.845, 78.352 |
| Unit cell angles | 90.00, 113.35, 90.00 |
Refinement procedure
| Resolution | 26.840 - 1.760 |
| R-factor | 0.175 |
| Rwork | 0.173 |
| R-free | 0.21200 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1sml |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.996 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 1.840 |
| High resolution limit [Å] | 1.760 | 1.760 |
| Rmerge | 0.067 | 0.162 |
| Number of reflections | 98730 | |
| <I/σ(I)> | 24 | 7 |
| Completeness [%] | 94.6 | 69.9 |
| Redundancy | 5.7 | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 0.1M Tris.Cl, 0.2M MgCl2, 18% PEG 4000, 5% MPD, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
