1B5G
HUMAN THROMBIN COMPLEXED WITH NOVEL SYNTHETIC PEPTIDE MIMETIC INHIBITOR AND HIRUGEN
Experimental procedure
| Source type | ROTATING ANODE |
| Source details | RIGAKU RUH2R |
| Temperature [K] | 273 |
| Detector technology | IMAGE PLATE |
| Collection date | 1996-10-15 |
| Detector | RIGAKU |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 70.840, 72.080, 73.000 |
| Unit cell angles | 90.00, 100.90, 90.00 |
Refinement procedure
| Resolution | 7.000 - 2.070 |
| R-factor | 0.164 * |
| Rwork | 0.164 |
| RMSD bond length | 0.017 |
| RMSD bond angle | 0.038 |
| Data reduction software | R-AXIS (II) |
| Data scaling software | R-AXIS (II) |
| Refinement software | PROFFT |
Data quality characteristics
| Overall | |
| High resolution limit [Å] | 2.100 |
| Rmerge | 0.072 |
| Number of reflections | 18339 |
| Completeness [%] | 81.0 |
| Redundancy | 2.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Vapor diffusion, hanging drop * | 7.3 | Skrzypczak, J., (1991) J. Mol. Biol., 221, 1379. * |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | protein | 3.0-3.7 (mg/ml) | |
| 2 | 1 | drop | sodium phosphate | 0.05 (M) | |
| 3 | 1 | drop | 0.375 (M) | ||
| 4 | 1 | drop | 0.5 (mM) | ||
| 5 | 1 | reservoir | sodium phosphate | 0.1 (M) | |
| 6 | 1 | reservoir | 1-2 (mM) | ||
| 7 | 1 | reservoir | PEG8000 | 25-30 (%(v/v)) |
