1F5R
RAT TRYPSINOGEN MUTANT COMPLEXED WITH BOVINE PANCREATIC TRYPSIN INHIBITOR
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU300 |
| Temperature [K] | 277 |
| Detector technology | IMAGE PLATE |
| Collection date | 1998-12-09 |
| Detector | RIGAKU RAXIS IV |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 92.568, 92.568, 62.126 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 21.690 - 1.650 |
| R-factor | 0.189 * |
| Rwork | 0.189 |
| R-free | 0.22000 |
| RMSD bond length | 0.005 |
| RMSD bond angle | 1.300 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | CNS |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 21.690 | 1.680 |
| High resolution limit [Å] | 1.650 | 1.650 |
| Rmerge | 0.050 | 0.242 |
| Total number of observations | 195481 * | |
| Number of reflections | 35860 * | |
| <I/σ(I)> | 18.56 | |
| Completeness [%] | 93.6 | 80.9 |
| Redundancy | 5.45 | 1.92 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 * | 298 | 22% PEG 3380, 300 mM Ammonium acetate, 100 mM Sodium acetate, , pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 298.0K |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | protein | 10-15 (mg/ml) | |
| 2 | 1 | drop | 1 (mM) | ||
| 3 | 1 | drop | 10 (mM) | ||
| 4 | 1 | drop | BPTI | ||
| 5 | 1 | reservoir | PEG3380 | 22 (%) | |
| 6 | 1 | reservoir | ammonium acetate | 0.3 (M) | |
| 7 | 1 | reservoir | sodium citrate | 0.1 (M) |
