6JQC
The structural basis of the beta-carbonic anhydrase CafC (wild type) of the filamentous fungus Aspergillus fumigatus
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PAL/PLS BEAMLINE 11C |
| Synchrotron site | PAL/PLS |
| Beamline | 11C |
| Temperature [K] | 77 |
| Detector technology | PIXEL |
| Collection date | 2018-09-17 |
| Detector | DECTRIS PILATUS3 S 6M |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 42.575, 80.066, 48.791 |
| Unit cell angles | 90.00, 115.84, 90.00 |
Refinement procedure
| Resolution | 40.070 - 1.800 |
| R-factor | 0.2003 |
| Rwork | 0.198 |
| R-free | 0.24909 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1g5c |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.662 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.860 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rpim | 0.069 | 0.311 |
| Number of reflections | 24771 | 2463 |
| <I/σ(I)> | 17.6 | |
| Completeness [%] | 91.5 | |
| Redundancy | 2.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 295 | 1-11% PEG2000 and 100 mM sodium acetate pH 4.5-5.5 |
