4M6V
Structure of the carboxyl transferase domain from Rhizobium etli pyruvate carboxylase with pyruvate and biocytin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-D |
Synchrotron site | APS |
Beamline | 21-ID-D |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-06-10 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 1.12706 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 84.641, 157.828, 244.953 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 49.660 - 2.400 |
R-factor | 0.18568 |
Rwork | 0.184 |
R-free | 0.22319 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4jx4 |
RMSD bond length | 0.011 |
RMSD bond angle | 1.385 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.460 |
High resolution limit [Å] | 2.400 | 2.400 |
Rmerge | 0.069 | 0.405 |
Number of reflections | 128103 | |
<I/σ(I)> | 25.7 | 5.2 |
Completeness [%] | 99.8 | 99.8 |
Redundancy | 7.2 | 7.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | BATCH CRYSTALLIZATION UNDER OIL | 6 | 298 | 11% (w/v) PEG 8000, 100 mM BisTris (pH 6.0), 345 mM Tetramethylammonium chloride, BATCH CRYSTALLIZATION UNDER OIL, temperature 298K |