2GZS
Enterobactin Hydolase IroE Complex with DFP
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.2.1 |
| Synchrotron site | ALS |
| Beamline | 8.2.1 |
| Temperature [K] | 120 |
| Detector technology | CCD |
| Collection date | 2006-02-10 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 0.97960, 0.9798, 0.9184 |
| Spacegroup name | P 1 |
| Unit cell lengths | 36.295, 38.361, 44.631 |
| Unit cell angles | 113.10, 93.99, 98.08 |
Refinement procedure
| Resolution | 20.000 - 1.400 |
| Rwork | 0.174 |
| R-free | 0.18600 |
| Structure solution method | MAD |
| RMSD bond length | 0.016 |
| RMSD bond angle | 0.035 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | SOLVE |
| Refinement software | SHELXL-97 |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 1.450 |
| High resolution limit [Å] | 1.400 | 1.400 |
| Number of reflections | 79213 | |
| Completeness [%] | 93.7 | 84.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 296 | 5-10% PEG 3350, 100 mM HEPES, 500 mM DFP, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 296K |
