2XV1
Crystal structure of the triscatecholate siderophore binding protein FeuA from Bacillus subtilis complexed with Ferric MECAM
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 | 2010-03-09 |
| Detector | ADSC CCD |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 39.960, 63.440, 56.210 |
| Unit cell angles | 90.00, 110.27, 90.00 |
Refinement procedure
| Resolution | 37.490 - 2.150 |
| R-factor | 0.18312 |
| Rwork | 0.178 |
| R-free | 0.23659 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2why |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.142 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.550 | 2.270 |
| High resolution limit [Å] | 2.150 | 2.150 |
| Rmerge | 0.050 | 0.600 |
| Number of reflections | 13962 | |
| <I/σ(I)> | 18.4 | 2.2 |
| Completeness [%] | 96.9 | 98.3 |
| Redundancy | 3 | 2.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 5 | PROTEIN WAS CRYSTALLIZED FROM 45% (V/V) PEG 300, 100 MM PHOSPHATE-CITRATE PH 5.00 |
