6Z8A
Outer membrane FoxA in complex with nocardamine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PETRA III, EMBL c/o DESY BEAMLINE P14 (MX2) |
Synchrotron site | PETRA III, EMBL c/o DESY |
Beamline | P14 (MX2) |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-11-28 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.98 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 95.222, 95.222, 178.651 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 82.460 - 2.950 |
R-factor | 0.2365 |
Rwork | 0.235 |
R-free | 0.27020 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6i98 |
RMSD bond length | 0.012 |
RMSD bond angle | 2.056 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 82.465 | 3.100 |
High resolution limit [Å] | 2.950 | 2.950 |
Rmerge | 0.180 | 2.580 |
Rmeas | 0.185 | |
Number of reflections | 14984 | 750 |
<I/σ(I)> | 12.8 | 1.4 |
Completeness [%] | 94.0 | 99 |
Redundancy | 20 | |
CC(1/2) | 0.990 | 0.697 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 288 | 1.8M Ammonium sulfate, 0.1M HEPES, 0.3% octyl glucopyranoside |