3FCA
Genetic Incorporation of a Metal-ion Chelating Amino Acid into proteins as biophysical probe
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] | 121 |
| Detector technology | CCD |
| Collection date | 2008-08-27 |
| Detector | ADSC QUANTUM 315 |
| Spacegroup name | P 42 21 2 |
| Unit cell lengths | 135.858, 135.858, 74.939 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 96.230 - 2.149 |
| R-factor | 0.209 |
| Rwork | 0.207 |
| R-free | 0.24400 |
| Structure solution method | SAD |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.228 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHASES |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 96.230 | 2.230 |
| High resolution limit [Å] | 2.149 | 2.149 |
| Rmerge | 0.076 | 0.173 |
| Number of reflections | 38516 | |
| <I/σ(I)> | 67.7 | 20.2 |
| Completeness [%] | 99.4 | 96.4 |
| Redundancy | 9.2 | 9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | 0.1 M Tris, 50% PEG 400, 200 mM NaCl, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
