1JYI
CONCANAVALIN A/12-MER PEPTIDE COMPLEX
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU200 |
Detector technology | IMAGE PLATE |
Detector | MARRESEARCH |
Wavelength(s) | 1.54178 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 102.545, 118.323, 252.591 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 10.000 - 2.750 |
Rwork | 0.192 |
R-free | 0.26500 |
Starting model (for MR) | 5cna |
RMSD bond length | 0.009 * |
RMSD bond angle | 1.632 * |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | CNS (0.5) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 10.000 | 10.000 |
High resolution limit [Å] | 2.750 | 2.750 |
Rmerge | 0.067 * | |
Total number of observations | 47255 * | |
Number of reflections | 34767 | |
<I/σ(I)> | 6 | |
Completeness [%] | 86.4 | 67.5 * |
Redundancy | 3.0 * |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | Vapor diffusion * | 9 * |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | peptide | 0.32 (mM) | |
2 | 1 | reservoir | ammonium sulfate | 1 (M) | |
3 | 1 | reservoir | Tris | 50 (mM) | pH9.0 |