6YU3
Crystal structure of MhsT in complex with L-phenylalanine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I24 |
Synchrotron site | Diamond |
Beamline | I24 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-10-11 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.96860 |
Spacegroup name | P 1 2 1 |
Unit cell lengths | 44.280, 49.890, 110.050 |
Unit cell angles | 90.00, 96.76, 90.00 |
Refinement procedure
Resolution | 45.384 - 2.250 |
R-factor | 0.2252 |
Rwork | 0.224 |
R-free | 0.25480 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4us3 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHENIX |
Refinement software | PHENIX (1.14_3260) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.500 | 2.320 |
High resolution limit [Å] | 2.250 | 2.250 |
Number of reflections | 22564 | 2236 |
<I/σ(I)> | 7.3 | |
Completeness [%] | 98.2 | |
Redundancy | 2.9 | |
CC(1/2) | 0.989 | 0.488 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293.15 | Crystallized using HiLiDe with DOPC as added lipid. Crystals were obtained in 14-24% PEG400, 0.3-0.5M NaCl, 0.1M Tris-HCl or HEPES-NaOH pH 7.0, 5% Trimethylamine N-oxide (TMANO), 5% or 10% glycerol. |