5IWE
E45Q mutant of phenazine biosynthesis protein PhzF in complex with (5R,6R)-6-azaniumyl-5-ethoxycyclohexa-1,3-diene-1-carboxylate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BESSY BEAMLINE 14.1 |
Synchrotron site | BESSY |
Beamline | 14.1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-07-07 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.91841 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 56.032, 56.032, 155.742 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 46.328 - 1.710 |
R-factor | 0.1505 |
Rwork | 0.149 |
R-free | 0.17340 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1u1v |
RMSD bond length | 0.007 |
RMSD bond angle | 0.945 |
Data reduction software | XDS (v.052) |
Data scaling software | Aimless (0.5.17) |
Phasing software | PHASER |
Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 77.870 | 1.740 |
High resolution limit [Å] | 1.710 | 1.710 |
Rmerge | 0.124 | 0.754 |
Number of reflections | 31593 | |
<I/σ(I)> | 8.9 | 1.9 |
Completeness [%] | 99.9 | 99.9 |
Redundancy | 5.2 | 4.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 4.6 | 293.15 | 0.085M sodium acetate pH 4.6, 0.17M ammonium acetate, 25.5% (w/v) PEG 4000, 15% (v/v) glycerol, temperature 293.15K, VAPOR DIFFUSION, SITTING DROP |