1M3E
Succinyl-COA:3-ketoacid COA transferase from pig heart (selenomethionine)
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X26C |
| Synchrotron site | NSLS |
| Beamline | X26C |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2002-05-06 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.978,0.979,0.961 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 60.168, 264.323, 62.688 |
| Unit cell angles | 90.00, 111.88, 90.00 |
Refinement procedure
| Resolution | 30.000 - 2.500 |
| R-factor | 0.246 |
| Rwork | 0.221 |
| R-free | 0.26500 |
| Structure solution method | MAD |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.400 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | SnB |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.590 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.085 | 0.188 |
| Total number of observations | 414407 * | |
| Number of reflections | 61401 | |
| <I/σ(I)> | 27.42 | 6.99 |
| Completeness [%] | 97.9 | 84.3 |
| Redundancy | 6.75 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 294 | PEG 2000, TrisCl, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 294.0K |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | reservoir | PEG2000 | 20 (%(w/v)) | |
| 2 | 1 | reservoir | Tris-Cl | 100 (mM) | pH8.0 |
| 3 | 1 | drop | 0.125-0.5 (M) | ||
| 4 | 1 | drop | protein | 22.8 (mg/ml) |
