2RA0
X-ray Structure of FXa in complex with 7-fluoroindazole
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | BRUKER AXS MICROSTAR |
| Temperature [K] | 200 |
| Detector technology | CCD |
| Collection date | 2004-04-15 |
| Detector | BRUKER SMART 6000 |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 48.871, 74.984, 75.089 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 53.060 - 2.300 |
| Rwork | 0.246 |
| R-free | 0.31400 |
| Data reduction software | SAINT |
| Data scaling software | SAINT (V7.03A) |
| Phasing software | CNS |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 74.000 | 2.380 |
| High resolution limit [Å] | 2.300 | 2.300 |
| Rmerge | 0.071 | |
| Number of reflections | 12708 | |
| <I/σ(I)> | 29.305 | 2.07 |
| Completeness [%] | 99.5 | 98.55 |
| Redundancy | 7.05 | 6.92 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 295 | 20%Peg 3350, 10mM CaCl2, 0.1M Tris-maleate pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 295K |
