4BAM
Thrombin in complex with inhibitor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU300 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Detector | MAR scanner 345 mm plate |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 69.410, 71.510, 72.160 |
Unit cell angles | 90.00, 100.34, 90.00 |
Refinement procedure
Resolution | 23.110 - 1.880 |
R-factor | 0.1699 |
Rwork | 0.169 |
R-free | 0.19530 |
Structure solution method | OTHER |
Starting model (for MR) | NONE |
RMSD bond length | 0.010 |
RMSD bond angle | 1.050 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Refinement software | BUSTER (2.11.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 24.710 | 1.930 |
High resolution limit [Å] | 1.880 | 1.880 |
Rmerge | 0.030 | 0.160 |
Number of reflections | 28262 | |
<I/σ(I)> | 32.8 | 9 |
Completeness [%] | 99.8 | 99.6 |
Redundancy | 4.1 | 3.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 |