5DH2
Structure of the siderophore periplasmic binding protein from the fuscachelin gene cluster of Thermobifida fusca in I222
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-G |
| Synchrotron site | APS |
| Beamline | 21-ID-G |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-08-24 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 0.97856 |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 106.632, 107.102, 136.287 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 37.783 - 2.590 |
| R-factor | 0.2312 |
| Rwork | 0.230 |
| R-free | 0.26320 |
| Structure solution method | SAD |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.744 |
| Data reduction software | XDS (OSX10.9.5_Darwin13.4.0) |
| Data scaling software | Aimless (0.5.8) |
| Phasing software | PHASER (2.5.6) |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 37.783 | 2.710 |
| High resolution limit [Å] | 2.590 | 2.590 |
| Rmerge | 0.047 | 0.516 |
| Number of reflections | 24621 | |
| <I/σ(I)> | 23.5 | 3.8 |
| Completeness [%] | 99.9 | 99.9 |
| Redundancy | 7.5 | 7.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 297 | 0.16 M ammonium acetate 32% w/v polyethylene glycol 4,000 0.1 M sodium acetate pH 4.6 |
