1M4N
CRYSTAL STRUCTURE OF APPLE ACC SYNTHASE IN COMPLEX WITH [2-(AMINO-OXY)ETHYL](5'-DEOXYADENOSIN-5'-YL)(METHYL)SULFONIUM
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | ENRAF-NONIUS |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2000-04-30 |
Detector | MARRESEARCH |
Wavelength(s) | 1.5418 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 105.000, 61.330, 76.940 |
Unit cell angles | 90.00, 123.48, 90.00 |
Refinement procedure
Resolution | 24.000 * - 2.010 |
Rwork | 0.199 |
R-free | 0.23200 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1b8g |
RMSD bond length | 0.006 |
RMSD bond angle | 22.100 * |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | CNS (1.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 24.000 * | 2.060 |
High resolution limit [Å] | 2.010 | 2.010 |
Rmerge | 0.077 | 0.290 |
Number of reflections | 26106 | |
<I/σ(I)> | 10.6 | 2 |
Completeness [%] | 96.2 | 66.5 |
Redundancy | 2.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.9 * | 293 | MPD, MES, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | protein | 20 (mg/ml) | |
2 | 1 | drop | AMA | 10 (mM) | |
3 | 1 | drop | HEPES | 50 (mM) | pH7.9 |
4 | 1 | drop | PLP | 10000 (nm) | |
5 | 1 | drop | dithiothreitol | 1 (mM) | |
6 | 1 | reservoir | MPD | 30 (%(v/v)) | |
7 | 1 | reservoir | MES | 50 (mM) | pH6.5 |