6G3I
Crystal structure of EDDS lyase in complex with N-(2-aminoethyl)aspartic acid (AEAA)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | BRUKER AXS MICROSTAR |
Temperature [K] | 110 |
Detector technology | IMAGE PLATE |
Collection date | 2013-06-05 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 1.54 |
Spacegroup name | F 2 2 2 |
Unit cell lengths | 145.482, 146.436, 152.824 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 51.603 - 2.410 |
R-factor | 0.1985 |
Rwork | 0.197 |
R-free | 0.23260 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6g3d |
RMSD bond length | 0.003 |
RMSD bond angle | 0.582 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 52.900 | 2.480 |
High resolution limit [Å] | 2.410 | 2.410 |
Rmerge | 0.115 | 0.600 |
Number of reflections | 31534 | |
<I/σ(I)> | 12.2 | 4.1 |
Completeness [%] | 99.9 | 99.5 |
Redundancy | 4.1 | 4.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 295 | 0.1 M Sodium cacodylate pH 6.5, 0.3 M AEAA |