4OV4
Isopropylmalate synthase binding with ketoisovalerate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE AR-NW12A |
Synchrotron site | Photon Factory |
Beamline | AR-NW12A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-12-16 |
Wavelength(s) | 1.0000 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 129.937, 129.937, 46.693 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 50.000 - 2.000 |
R-factor | 0.1615 |
Rwork | 0.159 |
R-free | 0.20940 |
Structure solution method | SAD |
RMSD bond length | 0.007 |
RMSD bond angle | 1.068 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | SOLVE |
Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.070 |
High resolution limit [Å] | 2.000 | 4.310 | 2.000 |
Rmerge | 0.063 | 0.040 | 0.472 |
Number of reflections | 30887 | ||
<I/σ(I)> | 13.4 | ||
Completeness [%] | 99.9 | 99.2 | 100 |
Redundancy | 10.5 | 10.6 | 9.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 8.5 | 298 | 0.1M Tris-HCl, pH 8.5, 0.8mM sodium formate, 30% pEG 2000 MME, vapor diffusion, temperature 298K |