1BHP
STRUCTURE OF BETA-PUROTHIONIN AT ROOM TEMPERATURE AND 1.7 ANGSTROMS RESOLUTION
Experimental procedure
| Detector technology | AREA DETECTOR |
| Collection date | 1992 |
| Detector | XUONG-HAMLIN MULTIWIRE |
| Spacegroup name | I 4 2 2 |
| Unit cell lengths | 53.940, 53.940, 72.750 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 10.000 - 1.700 |
| R-factor | 0.198 |
| R-free | 0.28100 |
| RMSD bond length | 0.017 |
| RMSD bond angle | 0.031 |
| Data reduction software | SDMS |
| Refinement software | PROLSQ |
Data quality characteristics
| Overall | |
| Rmerge | 0.096 |
| Number of reflections | 5160 |
| Completeness [%] | 87.1 |
| Redundancy | 3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Vapor diffusion * | 5.9 * |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | beta-purothionin | 15 (mg/ml) | |
| 2 | 1 | drop | dioxane | 2 (%) | |
| 3 | 1 | drop | MPD | 5 (%) | |
| 4 | 1 | drop | ammonium sulfate | 58 (%) | |
| 5 | 1 | drop | sodium cacodylate | 75 (mM) | |
| 6 | 1 | reservoir | MPD | 10 (%) | |
| 7 | 1 | reservoir | 20 (%) | ||
| 8 | 1 | reservoir | sodium cacodylate | 90 (mM) |
