2VVA
Human carbonic anhydrase in complex with CO2
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ELETTRA BEAMLINE 5.2R |
| Synchrotron site | ELETTRA |
| Beamline | 5.2R |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Detector | MARRESEARCH |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 42.589, 41.577, 72.636 |
| Unit cell angles | 90.00, 104.84, 90.00 |
Refinement procedure
| Resolution | 70.190 - 1.560 |
| R-factor | 0.156 |
| Rwork | 0.153 |
| R-free | 0.20000 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2cba |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.682 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 28.900 | 1.640 |
| High resolution limit [Å] | 1.560 | 1.560 |
| Rmerge | 0.040 | 0.110 |
| Number of reflections | 35235 | |
| Completeness [%] | 90.5 | 93.7 |
| Redundancy | 4.7 | 4.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 2.4 M (NH4)2(SO4). 0.1 M TRIS PH = 8.5 |
