3UN6
2.0 Angstrom Crystal Structure of Ligand Binding Component of ABC-type Import System from Staphylococcus aureus with Zinc bound
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-D |
| Synchrotron site | APS |
| Beamline | 21-ID-D |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-11-10 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 0.97903 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 45.080, 64.732, 45.468 |
| Unit cell angles | 90.00, 91.50, 90.00 |
Refinement procedure
| Resolution | 28.990 - 2.010 |
| R-factor | 0.16561 |
| Rwork | 0.164 |
| R-free | 0.20571 |
| Structure solution method | SAD |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.424 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | BUCCANEER |
| Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.030 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.098 | 0.430 |
| Number of reflections | 17064 | |
| <I/σ(I)> | 14.2 | 2.7 |
| Completeness [%] | 97.7 | 93.1 |
| Redundancy | 4.3 | 3.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8 | 295 | Protein: 5.8.0mG/mL, 0.5M Sodium chloride, 0.01M Tris-HCl (pH 8.3); Screen: PACT (A5), 0.1M SPG buffer (pH 8.0), 25% (v/v) PEG 1500, VAPOR DIFFUSION, SITTING DROP, temperature 295K |
