4YVY
Crystal structure of human carbonic anhydrase II in complex with hydroxylamine-O-sulfonamide, a molecule incorporating two zinc-binding groups.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-09-10 |
| Detector | RIGAKU SATURN 944 |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 42.236, 41.319, 72.153 |
| Unit cell angles | 90.00, 104.39, 90.00 |
Refinement procedure
| Resolution | 50.000 - 1.450 |
| Rwork | 0.162 |
| R-free | 0.19200 |
| Structure solution method | FOURIER SYNTHESIS |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | |
| High resolution limit [Å] | 1.450 | 1.450 |
| Rmerge | 0.049 | 0.412 |
| Number of reflections | 39182 | |
| <I/σ(I)> | 22.64 | 2.81 |
| Completeness [%] | 91.1 | 74.1 |
| Redundancy | 4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | 1.3 M sodium citrate and 0.1 M Tris-HCl, pH 8.5 |
