4AYY
Human thrombin - inhibitor complex
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | ELLIOTT GX-21 |
| Temperature [K] | 15 |
| Detector technology | AREA DETECTOR |
| Collection date | 1993-10-15 |
| Detector | MULTIWIRE XENTRONICS |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 90.800, 90.800, 132.500 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 24.750 - 2.600 |
| R-factor | 0.14917 |
| Rwork | 0.147 |
| R-free | 0.19663 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | IN HOUSE STRUCTURES |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.363 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.7.0025) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.700 |
| High resolution limit [Å] | 2.600 | 2.600 |
| Rmerge | 0.040 | |
| Number of reflections | 16836 | |
| Completeness [%] | 99.9 | 68.9 |
| Redundancy | 2.49 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 |
