6B00
Thermostabilized mutant of human carbonic anhydrase II - A65T L100H K154N L224S L240P A248T
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 5.0.2 |
Synchrotron site | ALS |
Beamline | 5.0.2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-02-08 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.00 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 47.620, 43.760, 57.990 |
Unit cell angles | 90.00, 100.72, 90.00 |
Refinement procedure
Resolution | 46.788 - 0.900 |
R-factor | 0.1208 |
Rwork | 0.120 |
R-free | 0.14420 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1ca2 |
RMSD bond length | 0.014 |
RMSD bond angle | 1.340 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHENIX |
Refinement software | PHENIX ((1.12_2829)) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 46.730 |
High resolution limit [Å] | 1.110 |
Rmeas | 0.053 |
Number of reflections | 74402 |
<I/σ(I)> | 20.22 |
Completeness [%] | 80.1 |
Redundancy | 6.12 |
CC(1/2) | 0.990 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 278 | 50 mM Tris pH 8, 2.5 M ammonium sulfate | |
2 | VAPOR DIFFUSION, HANGING DROP | 278 | 50 mM Tris pH 8, 2.5 M ammonium sulfate | |
3 | VAPOR DIFFUSION, HANGING DROP | 278 | 50 mM Tris pH 8, 2.5 M ammonium sulfate | |
4 | VAPOR DIFFUSION, HANGING DROP | 278 | 50 mM Tris pH 8, 2.5 M ammonium sulfate | |
5 | VAPOR DIFFUSION, HANGING DROP | 278 | 50 mM Tris pH 8, 2.5 M ammonium sulfate |