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 |