6LUV
apo- Carbonic Anhydrase II pH 7.8 20 atm CO2
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PAL/PLS BEAMLINE 7A (6B, 6C1) |
Synchrotron site | PAL/PLS |
Beamline | 7A (6B, 6C1) |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2019-12-17 |
Detector | ADSC QUANTUM 270 |
Wavelength(s) | 0.9793 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 42.256, 41.383, 72.004 |
Unit cell angles | 90.00, 104.18, 90.00 |
Refinement procedure
Resolution | 30.000 - 1.200 |
Rwork | 0.117 |
R-free | 0.14830 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5dsr |
RMSD bond length | 0.030 |
RMSD bond angle | 2.435 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | REFMAC (5.8.0124) |
Refinement software | REFMAC (5.8.0124 2015/06/02) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 1.220 |
High resolution limit [Å] | 1.200 | 1.200 |
Rmerge | 0.071 | 0.481 |
Rmeas | 0.077 | 0.517 |
Rpim | 0.028 | 0.191 |
Number of reflections | 71467 | 3475 |
<I/σ(I)> | 21.2 | 5.1 |
Completeness [%] | 94.3 | 91.2 |
Redundancy | 7.5 | 7.4 |
CC(1/2) | 0.994 | 0.903 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.8 | 293 | 1.3 M sodium citrate, 50 mM Tris-HCl |