1RXI
pI258 arsenate reductase (ArsC) triple mutant C10S/C15A/C82S
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-2 |
| Synchrotron site | ESRF |
| Beamline | ID14-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2003-07-31 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.933 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 32.034, 34.064, 63.355 |
| Unit cell angles | 90.00, 97.33, 90.00 |
Refinement procedure
| Resolution | 23.900 - 1.500 |
| R-factor | 0.211 |
| Rwork | 0.209 |
| R-free | 0.23100 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.370 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | AMoRE |
| Refinement software | CNS (1.0) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 23.900 | 1.550 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Rmerge | 0.064 | 0.277 |
| Number of reflections | 21553 | |
| <I/σ(I)> | 12.96 | |
| Completeness [%] | 98.1 | 95.8 |
| Redundancy | 4.73 | 3.32 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 293 | potassium chloride, sodium perchlorate, PEG4000, TRIS, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
