4M52
Structure of Mtb Lpd bound to SL827
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-C |
Synchrotron site | APS |
Beamline | 24-ID-C |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-06-14 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.9795 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 82.521, 111.953, 98.034 |
Unit cell angles | 90.00, 94.43, 90.00 |
Refinement procedure
Resolution | 39.009 - 2.400 |
R-factor | 0.1721 |
Rwork | 0.169 |
R-free | 0.22180 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2a8x |
RMSD bond length | 0.004 |
RMSD bond angle | 0.880 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | PHENIX ((phenix.refine: 1.8.2_1309)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.000 | 2.440 |
High resolution limit [Å] | 2.400 | 2.400 |
Rmerge | 0.097 | 0.475 |
Number of reflections | 67889 | |
<I/σ(I)> | 15.5 | 3.6 |
Completeness [%] | 96.1 | 95.7 |
Redundancy | 3 | 3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 291 | 100 mM Tris pH 8.5, 50 mM NaCl, 19% PEG 10000 (w/v), VAPOR DIFFUSION, HANGING DROP, temperature 291K |