3RMU
Crystal structure of human Methylmalonyl-CoA epimerase, MCEE
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I02 |
| Synchrotron site | Diamond |
| Beamline | I02 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-12-08 |
| Detector | ADSC QUANTUM 315 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 53.120, 66.690, 76.980 |
| Unit cell angles | 90.00, 90.10, 90.00 |
Refinement procedure
| Resolution | 36.590 - 1.800 |
| R-factor | 0.18961 |
| Rwork | 0.187 |
| R-free | 0.23722 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 30A4 |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.505 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0110) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 38.490 | 1.900 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.076 | 0.565 |
| Number of reflections | 49519 | |
| <I/σ(I)> | 8.9 | 2 |
| Completeness [%] | 99.2 | 99.7 |
| Redundancy | 3.6 | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293.15 | 30% PEG smears (PEG400, PEG550 MME, PEG600, PEG1000), 0.1 M Tris, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 293.15K |
