4D9K
Crystal structure of Escherichia coli Diaminopropionate ammonia lyase in apo form
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL26B1 |
Synchrotron site | SPring-8 |
Beamline | BL26B1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-03-14 |
Detector | RIGAKU JUPITER 210 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 85.778, 94.145, 94.687 |
Unit cell angles | 90.00, 110.01, 90.00 |
Refinement procedure
Resolution | 40.650 - 2.190 |
R-factor | 0.21574 |
Rwork | 0.213 |
R-free | 0.26065 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4d9i |
RMSD bond length | 0.005 |
RMSD bond angle | 1.022 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.280 |
High resolution limit [Å] | 2.190 | 2.200 |
Rmerge | 0.078 | 0.357 |
Number of reflections | 71324 | |
<I/σ(I)> | 18.9 | 2.48 |
Completeness [%] | 98.3 | 97.5 |
Redundancy | 3.6 | 3.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.3 | 298 | 20% PEG 3350, 70mM magnesium chloride, 50mM lithium sulfate, 6mM sodium citrate, 5mM beta mercaptoethanol, 40mM tris HCl pH 8.3, VAPOR DIFFUSION, HANGING DROP, temperature 298K |