3DG9
Crystal Structure of Malonate Decarboxylase from Bordatella bronchiseptica
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-03-13 |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 38.666, 65.849, 42.209 |
| Unit cell angles | 90.00, 110.82, 90.00 |
Refinement procedure
| Resolution | 39.453 - 1.500 |
| R-factor | 0.157 |
| Rwork | 0.155 |
| R-free | 0.18800 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.147 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | MLPHARE |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | |
| High resolution limit [Å] | 1.500 | 1.500 |
| Rmerge | 0.093 | 0.292 |
| Number of reflections | 30804 | |
| <I/σ(I)> | 8.5 | 2.7 |
| Completeness [%] | 97.2 | |
| Redundancy | 3.3 | 3.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | well solution 0.1M Tris pH8.0 and 30% Peg 10K, Protein 10-15mg/ml in Tris pH7.5, VAPOR DIFFUSION, SITTING DROP |
