3BIC
Crystal structure of human methylmalonyl-CoA mutase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-09-22 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.97649 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 103.750, 95.150, 119.160 |
| Unit cell angles | 90.00, 108.31, 90.00 |
Refinement procedure
| Resolution | 37.420 - 2.600 |
| R-factor | 0.21758 |
| Rwork | 0.217 |
| R-free | 0.24341 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1req |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.121 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.3.0040) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 37.420 | 2.740 |
| High resolution limit [Å] | 2.600 | 2.600 |
| Rmerge | 0.122 | 0.698 |
| Number of reflections | 67606 | |
| <I/σ(I)> | 9.5 | 1.6 |
| Completeness [%] | 99.6 | 97.3 |
| Redundancy | 3.6 | 2.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | 1.60M Na/K2PO4, 0.1M HEPES pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
