1L7A
structural Genomics, crystal structure of Cephalosporin C deacetylase
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2002-02-06 |
| Detector | SBC-2 |
| Wavelength(s) | 0.9793, 0.9791, 0.9520 |
| Spacegroup name | H 3 2 |
| Unit cell lengths | 156.446, 156.446, 131.748 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 47.730 - 1.500 |
| R-factor | 0.186 |
| Rwork | 0.185 |
| R-free | 0.18900 |
| Structure solution method | MAD |
| RMSD bond length | 0.008 |
| RMSD bond angle | 2.400 |
| Data reduction software | HKL-2000 |
| Data scaling software | d*TREK |
| Phasing software | CNS |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.580 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Rmerge | 0.078 | 0.325 |
| Number of reflections | 96738 | |
| <I/σ(I)> | 27.78 | 4.955 |
| Completeness [%] | 99.8 | 99.6 |
| Redundancy | 10.92 | 3.54 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 298 | PEG4000, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
