1D7R
CRYSTAL STRUCTURE OF THE COMPLEX OF 2,2-DIALKYLGLYCINE DECARBOXYLASE WITH 5PA
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | MPG/DESY, HAMBURG BEAMLINE BW6 |
Synchrotron site | MPG/DESY, HAMBURG |
Beamline | BW6 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 1996-06-26 |
Detector | MARRESEARCH |
Spacegroup name | P 64 2 2 |
Unit cell lengths | 152.650, 152.650, 86.220 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 10.000 - 2.000 |
Rwork | 0.215 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2dkb |
RMSD bond length | 0.011 |
RMSD bond angle | 1.540 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | TNT |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 35.000 | 2.050 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.049 | 0.318 |
Number of reflections | 42301 | |
<I/σ(I)> | 9.8 | |
Completeness [%] | 96.6 | 96.4 |
Redundancy | 3.9 | 3.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 298 | 4 micro litter of drop was mixed with 2 micro litter reservoir * |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | protein | 31.5 (mg/ml) | |
2 | 1 | drop | potassium phosphate | 5 (mM) | |
3 | 1 | drop | PLP | 0.015 (mM) | |
4 | 1 | reservoir | sodium pyruvate | 150-200 (mM) | |
5 | 1 | reservoir | PEG4000 | 15 (%) | |
6 | 1 | reservoir | MES-KOH | 30 (mM) |