5IY2
Structure of apo OXA-143 carbapenemase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL12-2 |
Synchrotron site | SSRL |
Beamline | BL12-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-07-18 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9795 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 40.955, 62.333, 87.093 |
Unit cell angles | 90.00, 91.72, 90.00 |
Refinement procedure
Resolution | 36.625 - 1.150 |
R-factor | 0.1374 |
Rwork | 0.136 |
R-free | 0.16060 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.005 |
RMSD bond angle | 0.820 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | MOLREP |
Refinement software | PHENIX (1.10.1_2155) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 36.625 | 1.180 |
High resolution limit [Å] | 1.150 | 1.150 |
Rmerge | 0.058 | 0.623 |
Number of reflections | 150305 | |
<I/σ(I)> | 11.45 | 1.9 |
Completeness [%] | 96.1 | 87.8 |
Redundancy | 3.4 | 3 |
CC(1/2) | 0.999 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 298 | 0.1 M Tris-HCl pH 8.5, 0.2 M MgCl2, 30% PEG 4000 |