3MWE
Truncated Human ATP-Citrate Lyase with Tartrate Bound
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.3.1 |
Synchrotron site | ALS |
Beamline | 8.3.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-12-01 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.11587 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 168.191, 60.793, 109.176 |
Unit cell angles | 90.00, 124.96, 90.00 |
Refinement procedure
Resolution | 44.736 - 2.200 |
R-factor | 0.1815 |
Rwork | 0.179 |
R-free | 0.22750 |
Structure solution method | FOURIER SYNTHESIS |
RMSD bond length | 0.008 |
RMSD bond angle | 1.089 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHENIX |
Refinement software | PHENIX ((phenix.refine: 1.6.1_357)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 55.640 | 2.320 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.079 | 0.450 |
Number of reflections | 45944 | |
<I/σ(I)> | 9.2 | 2.4 |
Completeness [%] | 99.4 | 99.7 |
Redundancy | 2.8 | 2.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.1 | 294 | 10% (w/v) PEG 3350, 100 mM sodium tartrate, 100 mM Tris-HCl, pH 7.1, VAPOR DIFFUSION, HANGING DROP, temperature 294K |