5BOH
Crystal Structure of OXA-58 with the Substrate-Binding Cleft in a Closed State
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL26B1 |
Synchrotron site | SPring-8 |
Beamline | BL26B1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-12-14 |
Detector | RIGAKU SATURN A200 |
Wavelength(s) | 1.0000 |
Spacegroup name | H 3 |
Unit cell lengths | 75.290, 75.290, 120.682 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 28.680 - 1.800 |
R-factor | 0.1584 |
Rwork | 0.149 |
R-free | 0.16890 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4oh0 |
RMSD bond length | 0.007 |
RMSD bond angle | 1.120 |
Data reduction software | SCALA (3.3.20) |
Data scaling software | SCALA (3.3.20) |
Phasing software | PHASER (2.5.3) |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 28.680 | 1.900 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.093 | 0.346 |
Number of reflections | 47274 | |
<I/σ(I)> | 5.7 | 2.2 |
Completeness [%] | 100.0 | 100 |
Redundancy | 5.5 | 5.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 297 | 0.1M MOPS pH 7.0, 1.5M Li2SO4 |