8B43
Crystal structure of ferrioxamine transporter
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PETRA III, EMBL c/o DESY BEAMLINE P13 (MX1) |
Synchrotron site | PETRA III, EMBL c/o DESY |
Beamline | P13 (MX1) |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-03-10 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.976 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 95.411, 95.411, 177.984 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 59.330 - 2.490 |
R-factor | 0.2192 |
Rwork | 0.217 |
R-free | 0.25890 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6i96 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHENIX |
Refinement software | PHENIX (1.18.1_3865) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 82.628 | 2.810 |
High resolution limit [Å] | 2.489 | 2.489 |
Rmerge | 0.180 | 1.910 |
Rmeas | 0.185 | |
Rpim | 0.043 | 0.506 |
Number of reflections | 20915 | 1045 |
<I/σ(I)> | 16 | 1.8 |
Completeness [%] | 94.1 | 74.4 |
Redundancy | 18.1 | 14.5 |
CC(1/2) | 0.998 | 0.727 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | BATCH MODE | 293 | 1.8 M ammonium sulfate 0.1 M MES pH 6.5 0.7% octyl glucoside |