3N0K
Proteinase inhibitor from Coprinopsis cinerea
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU200 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2009-10-10 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 1.54 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 78.631, 38.192, 55.078 |
| Unit cell angles | 90.00, 96.87, 90.00 |
Refinement procedure
| Resolution | 16.870 - 1.800 |
| R-factor | 0.169 |
| Rwork | 0.168 |
| R-free | 0.19400 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.021 |
| RMSD bond angle | 1.761 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | AMoRE |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 16.870 | 1.830 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.034 | 0.115 |
| Number of reflections | 14500 | |
| <I/σ(I)> | 51.3 | |
| Completeness [%] | 95.0 | 83.4 |
| Redundancy | 7.1 | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6 | 293 | 0.1 M MES buffer, 20% MPD, pH 6.0, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
