4HMK
Crystal structure of LeuT-E290S with bound Br
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-4 |
Synchrotron site | ESRF |
Beamline | ID14-4 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-06-30 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.94 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 84.140, 92.320, 87.210 |
Unit cell angles | 90.00, 94.25, 90.00 |
Refinement procedure
Resolution | 63.304 - 3.000 |
R-factor | 0.208 |
Rwork | 0.205 |
R-free | 0.26090 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 1.183 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX ((phenix.refine: 1.6.4_486)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 70.000 | 3.100 |
High resolution limit [Å] | 3.000 | 3.000 |
Number of reflections | 26770 | |
Completeness [%] | 99.7 | 99.4 |
Redundancy | 12.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 292 | 24% PEG 550MME, 0.6M NaBr, 0.1M Hepes, pH 7.0, 100nM Leu, 2.4% w/v OG, VAPOR DIFFUSION, sitting drop, temperature 292K |