5AQ6
Structure of E. coli ZinT at 1.79 Angstrom
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 273 |
| Detector technology | PIXEL |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 62.010, 62.010, 149.720 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 47.754 - 1.790 |
| R-factor | 0.1763 |
| Rwork | 0.175 |
| R-free | 0.20830 |
| Structure solution method | SAD |
| Starting model (for MR) | NONE |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.318 |
| Data reduction software | XDS (PROGRAM PACKAGE) |
| Data scaling software | XDS (PROGRAM PACKAGE) |
| Phasing software | HKL2Map |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.800 | 1.850 |
| High resolution limit [Å] | 1.790 | 1.790 |
| Rmerge | 0.070 | 0.570 |
| Number of reflections | 28379 | |
| <I/σ(I)> | 15.6 | 1.7 |
| Completeness [%] | 99.6 | 97 |
| Redundancy | 6.7 | 4.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 75 MM ZINC ACETATE 18 % PEG 3350 |
