3MBZ
OXA-24 beta-lactamase complex soaked with 10mM SA4-17 inhibitor for 15min
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X29A |
Synchrotron site | NSLS |
Beamline | X29A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-02-28 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.29 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 103.083, 103.083, 85.802 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 32.600 - 2.600 |
R-factor | 0.17566 |
Rwork | 0.174 |
R-free | 0.21116 |
Structure solution method | FOURIER SYNTHESIS |
RMSD bond length | 0.011 |
RMSD bond angle | 1.390 |
Refinement software | REFMAC (5.5.0088) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.690 |
High resolution limit [Å] | 2.600 | 2.600 |
Rmerge | 0.110 | 0.301 |
Number of reflections | 13786 | |
<I/σ(I)> | 12.1 | 2.1 |
Completeness [%] | 93.4 | 59.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 2M (NH3)2SO4, 0.1M Tris pH 8.5, room temperature, VAPOR DIFFUSION, SITTING DROP |