5DSP
Structure of CO2 released apo-form of human carbonic anhydrase II with 40 sec warming
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CHESS BEAMLINE F2 |
| Synchrotron site | CHESS |
| Beamline | F2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-12-23 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 0.9795 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 42.069, 41.289, 71.885 |
| Unit cell angles | 90.00, 104.28, 90.00 |
Refinement procedure
| Resolution | 24.510 - 1.400 |
| R-factor | 0.11695 |
| Rwork | 0.115 |
| R-free | 0.15667 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3d93 |
| RMSD bond length | 0.019 |
| RMSD bond angle | 1.764 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.420 |
| High resolution limit [Å] | 1.400 | 1.400 |
| Number of reflections | 47512 | |
| <I/σ(I)> | 33.3 | 2.3 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 7.3 | 6.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 1.3 M sodium citrate 100 mM TrisHCl pH 7.8 |
