1EF9
THE CRYSTAL STRUCTURE OF METHYLMALONYL COA DECARBOXYLASE COMPLEXED WITH 2S-CARBOXYPROPYL COA
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU200 |
| Temperature [K] | 298 |
| Detector technology | AREA DETECTOR |
| Collection date | 1999-10-07 |
| Detector | SIEMENS HI-STAR |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 85.700, 142.400, 89.700 |
| Unit cell angles | 90.00, 109.20, 90.00 |
Refinement procedure
| Resolution | 30.000 - 2.700 |
| R-factor | 0.19 |
| RMSD bond length | 0.012 |
| RMSD bond angle | 2.270 |
| Data scaling software | XDS |
| Phasing software | AMoRE |
| Refinement software | TNT (5E) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.820 |
| High resolution limit [Å] | 2.700 | 2.700 |
| Rmerge | 0.043 | 0.152 |
| Number of reflections | 49630 | |
| <I/σ(I)> | 15.3 | |
| Completeness [%] | 87.0 | 75 |
| Redundancy | 2.44 | 1.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6 | 298 | PEG8000, 50 mM magnesium chloride, 100 mM MES, 5 mM sodium azide, pH 6.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | reservoir | PEG8000 | 5 (%) | |
| 2 | 1 | reservoir | 50 (mM) | ||
| 3 | 1 | reservoir | MES | 100 (mM) | |
| 4 | 1 | reservoir | sodium azide | 5 (mM) | |
| 5 | 1 | drop | inhibitor | 2.5 (mM) |
