4THN
THE CRYSTAL STRUCTURE OF ALPHA-THROMBIN-HIRUNORM IV COMPLEX REVEALS A NOVEL SPECIFICITY SITE RECOGNITION MODE.
Experimental procedure
| Temperature [K] | 293 |
| Detector technology | IMAGE PLATE |
| Collection date | 1996-06 |
| Detector | RIGAKU RAXIS II |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 72.300, 72.700, 73.600 |
| Unit cell angles | 90.00, 100.00, 90.00 |
Refinement procedure
| Resolution | 20.000 - 2.500 |
| Rwork | 0.173 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1HAH (J. VIJAYALAKSHMI ET AL. PROTEIN SCI. 3 2254-71) |
| RMSD bond length | 0.014 |
| RMSD bond angle | 19.634 * |
| Data reduction software | MOSFLM |
| Data scaling software | CCP4 |
| Phasing software | CCP4 |
| Refinement software | TNT (5E) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 2.630 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.104 | 0.439 |
| Total number of observations | 33294 * | |
| Number of reflections | 12580 | |
| <I/σ(I)> | 5 | 1.6 |
| Completeness [%] | 96.3 | 97.4 |
| Redundancy | 2.6 | 2.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Vapor diffusion * | 7 | 4 * | pH 7.0 |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | sodium Hepes | 0.05 (M) | |
| 2 | 1 | drop | PEG4000 | 10 (%(w/v)) | |
| 3 | 1 | drop | 0.02 (%) | ||
| 4 | 1 | drop | thrombin-hirugen complex | 12 (mg/ml) | |
| 5 | 1 | reservoir | sodium Hepes | 0.1 (M) | |
| 6 | 1 | reservoir | PEG4000 | 20 (%(w/v)) | |
| 7 | 1 | reservoir | 0.04 (%) |
