7XKY
Crystal structure of Methanocaldococcus jannaschii two-subunit Fumarate hydratase apo-protein complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE BM14 |
Synchrotron site | ESRF |
Beamline | BM14 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2016-07-06 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.9787 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 116.949, 61.700, 83.880 |
Unit cell angles | 90.00, 123.90, 90.00 |
Refinement procedure
Resolution | 52.130 - 2.460 |
R-factor | 0.18586 |
Rwork | 0.184 |
R-free | 0.22394 |
Structure solution method | SAD |
RMSD bond length | 0.009 |
RMSD bond angle | 1.825 |
Data reduction software | iMOSFLM |
Data scaling software | SCALA |
Phasing software | AutoSol |
Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 69.620 | 2.590 |
High resolution limit [Å] | 2.460 | 2.460 |
Rmerge | 0.124 | 0.525 |
Number of reflections | 17961 | 2578 |
<I/σ(I)> | 11.2 | |
Completeness [%] | 98.4 | |
Redundancy | 7.9 | |
CC(1/2) | 0.995 | 0.871 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | MICROBATCH | 297 | 0.2 M magnesium chloride hexahydrate, 0.1 M BIS-TRIS, pH 5.5, 25% w/v polyethylene glycol 3,350 |