1N8O
Crystal structure of a complex between bovine chymotrypsin and ecotin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU200 |
Temperature [K] | 277 |
Detector technology | IMAGE PLATE |
Collection date | 1993-10-10 |
Detector | MARRESEARCH |
Wavelength(s) | 1.5418 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 95.500, 63.800, 79.600 |
Unit cell angles | 90.00, 91.70, 90.00 |
Refinement procedure
Resolution | 30.000 - 2.000 |
R-factor | 0.205 |
Rwork | 0.205 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | Bovine Chymotrypsin Ecotin |
RMSD bond length | 0.002 |
RMSD bond angle | 1.890 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | AMoRE |
Refinement software | X-PLOR |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.100 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.065 | 0.270 |
Number of reflections | 30343 | |
Completeness [%] | 91.0 | 67 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4 | 293 | Ammonium sulfate 1.3M, Sodium Acetate 0.1M, 1% PEG 200, pH 4.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K |