1LUG
Full Matrix Error Analysis of Carbonic Anhydrase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL9-1 |
| Synchrotron site | SSRL |
| Beamline | BL9-1 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 1999-06-01 |
| Detector | MAR scanner 345 mm plate |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 42.064, 41.311, 71.868 |
| Unit cell angles | 90.00, 104.23, 90.00 |
Refinement procedure
| Resolution | 15.000 - 0.950 |
| Rwork | 0.119 |
| R-free | 0.14110 |
| Structure solution method | isomorphous structure |
| Starting model (for MR) | 2cba |
| RMSD bond length | 0.030 |
| RMSD bond angle | 0.048 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | SHELX |
| Refinement software | SHELXL-97 |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 0.920 |
| High resolution limit [Å] | 0.900 | 0.900 |
| Rmerge | 0.069 | 0.440 |
| Number of reflections | 172463 | |
| <I/σ(I)> | 17 | 1.34 |
| Completeness [%] | 98.0 | 96 |
| Redundancy | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | ammonium sulfate, Tris-Cl, p-hydroxymercuribenzoate, DMSO, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
