1RIW
Thrombin in complex with natural product inhibitor Oscillarin
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU300 |
| Temperature [K] | 293 |
| Detector technology | IMAGE PLATE |
| Collection date | 2003-10-24 |
| Detector | MARRESEARCH |
| Wavelength(s) | 1.5418 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 71.055, 72.366, 70.830 |
| Unit cell angles | 90.00, 100.19, 90.00 |
Refinement procedure
| Resolution | 24.680 - 2.040 |
| Rwork | 0.213 |
| R-free | 0.23200 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.400 |
| Data reduction software | MOSFLM |
| Data scaling software | CCP4 ((SCALA)) |
| Phasing software | CNX (2000) |
| Refinement software | CNX (2000) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 24.700 | 2.150 |
| High resolution limit [Å] | 2.050 | 2.040 |
| Number of reflections | 22273 | |
| <I/σ(I)> | 7.4 | 3.3 |
| Completeness [%] | 98.8 | 94.7 |
| Redundancy | 2.1 | 3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.3 | 293 | PEG 8000, pH 7.3, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
