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 |