3TVN
Human Carbonic Anhydrase II Proton Transfer Mutant
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU200 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2010-03-10 |
| Detector | RIGAKU RAXIS IV++ |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 42.005, 41.223, 72.059 |
| Unit cell angles | 90.00, 104.32, 90.00 |
Refinement procedure
| Resolution | 26.641 - 1.497 |
| R-factor | 0.1774 |
| Rwork | 0.175 |
| R-free | 0.21080 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.086 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.6.3_467) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 26.641 | 26.641 | 1.550 |
| High resolution limit [Å] | 1.497 | 3.230 | 1.497 |
| Rmerge | 0.073 | 0.064 | 0.389 |
| Number of reflections | 35808 | ||
| <I/σ(I)> | 22 | ||
| Completeness [%] | 92.5 | 93.2 | 88.5 |
| Redundancy | 5.7 | 5.2 | 5.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 298 | 1.25 M sodium citrate, 100 mM Tris-HCl, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
