1K54
OXA-10 class D beta-lactamase partially acylated with reacted 6beta-(1-hydroxy-1-methylethyl) penicillanic acid
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-2 |
Synchrotron site | ESRF |
Beamline | ID14-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2000-06-27 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.933 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 66.649, 82.480, 101.957 |
Unit cell angles | 90.00, 95.38, 90.00 |
Refinement procedure
Resolution | 44.770 - 1.700 |
R-factor | 0.17688 * |
Rwork | 0.177 |
R-free | 0.21043 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 1e4d |
RMSD bond length | 0.006 * |
RMSD bond angle | 14.341 * |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 44.770 | 1.790 |
High resolution limit [Å] | 1.700 | 1.700 |
Rmerge | 0.064 | 0.289 |
Total number of observations | 432971 * | |
Number of reflections | 119631 | 16474 * |
<I/σ(I)> | 12.9 | 3.2 |
Completeness [%] | 99.1 | 93.8 |
Redundancy | 3.6 | 2.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.8 * | 4 * | ammonium sulafate, HEPES, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | protein | 10 (mg/ml) | |
2 | 1 | drop | sodium potassium phosphate | 20 (mM) | pH7.8 |
3 | 1 | reservoir | ammonium sulfate | 2.0 (M) | |
4 | 1 | reservoir | Tris-HCl | 100 (mM) | pH8.5, or 100mM Na/Hepes(pH7.5) |