8VQ7
hCA-II-apo structure
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 24-ID-E |
| Synchrotron site | APS |
| Beamline | 24-ID-E |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-06-19 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.97918 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 42.431, 41.283, 72.758 |
| Unit cell angles | 90.00, 104.38, 90.00 |
Refinement procedure
| Resolution | 41.136 - 1.409 |
| Rwork | 0.133 |
| R-free | 0.17240 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.651 |
| Data reduction software | xia2 |
| Data scaling software | xia2 |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.8.0411) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 41.280 | 1.430 |
| High resolution limit [Å] | 1.409 | 1.410 |
| Rmerge | 0.177 | |
| Rmeas | 0.206 | |
| Rpim | 0.103 | |
| Number of reflections | 46783 | 2175 |
| <I/σ(I)> | 9.3 | 4.5 |
| Completeness [%] | 98.8 | 94 |
| Redundancy | 4.5 | 4.1 |
| CC(1/2) | 0.948 | 0.180 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 298 | 2.1 M Malonate, Tris, pH 8.5 |
