6MFI
MIM-2 Metallo-Beta-Lactamase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
Synchrotron site | Australian Synchrotron |
Beamline | MX2 |
Temperature [K] | 80 |
Detector technology | PIXEL |
Collection date | 2016-07-13 |
Detector | DECTRIS PILATUS 200K |
Wavelength(s) | 0.7107 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 51.672, 69.527, 76.541 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 42.826 - 1.839 |
R-factor | 0.2641 |
Rwork | 0.260 |
R-free | 0.30900 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1sml |
RMSD bond length | 0.002 |
RMSD bond angle | 0.568 |
Data reduction software | HKL-2000 |
Data scaling software | XDS |
Phasing software | PHENIX |
Refinement software | PHENIX ((1.11.1_2575: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 42.830 | 1.905 |
High resolution limit [Å] | 1.839 | 1.839 |
Rmerge | 0.168 | |
Rpim | 0.060 | |
Number of reflections | 24468 | 24436 |
<I/σ(I)> | 7.5 | |
Completeness [%] | 99.3 | 99.23 |
Redundancy | 6.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 323 | 0.1 mM DS56E8 (a detergent), 0.1 M sodium citrate, pH 5.5, and 22% w/v PEG-3350 |