1W88
The crystal structure of pyruvate dehydrogenase E1(D180N,E183Q) bound to the peripheral subunit binding domain of E2
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-2 |
Synchrotron site | ESRF |
Beamline | ID14-2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-07-14 |
Detector | ADSC CCD |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 92.180, 133.690, 245.610 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 19.980 - 2.300 |
R-factor | 0.202 |
Rwork | 0.199 |
R-free | 0.26200 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1w85 |
RMSD bond length | 0.011 |
RMSD bond angle | 1.209 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.170 |
High resolution limit [Å] | 2.100 | 2.100 |
Rmerge | 0.080 | 0.820 |
Number of reflections | 176574 | |
<I/σ(I)> | 32.4 | 7.1 |
Completeness [%] | 100.0 | 100 |
Redundancy | 9.4 | 9.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 5 | 15% PEG 4000, 0.2M IMIDAZOLE MALATE PH5, pH 5.00 |