4ZTC
PglE Aminotransferase in complex with External Aldimine, Mutant K184A
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU200 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-04-25 |
Detector | Bruker Platinum 135 |
Wavelength(s) | 1.5418 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 66.161, 66.161, 169.013 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 29.610 - 2.000 |
R-factor | 0.19184 |
Rwork | 0.188 |
R-free | 0.25445 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | PDB 1O61 |
RMSD bond length | 0.014 |
RMSD bond angle | 1.715 |
Data reduction software | SAINT |
Data scaling software | SADABS |
Phasing software | PHASER |
Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.100 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.053 | 0.237 |
Number of reflections | 26017 | |
<I/σ(I)> | 15.1 | 2.8 |
Completeness [%] | 99.9 | 97.4 |
Redundancy | 13.6 | 6.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 292 | 15-18% PEG3350, 1 mM PLP, 10 mM UDP-2-acetamido-4-amino-2,4,6-trideoxyglucose, 100 mM MOPS, 200 mM tetraethylammoniumchloride |