3IX4
LasR-TP1 complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-D |
Synchrotron site | APS |
Beamline | 21-ID-D |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Detector | MAR scanner 300 mm plate |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 54.196, 84.546, 156.385 |
Unit cell angles | 90.00, 95.97, 90.00 |
Refinement procedure
Resolution | 25.000 - 1.800 |
R-factor | 0.20126 |
Rwork | 0.199 |
R-free | 0.24675 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3ix3 |
RMSD bond length | 0.007 |
RMSD bond angle | 1.092 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.860 |
High resolution limit [Å] | 1.800 | 1.800 |
Number of reflections | 127357 | |
<I/σ(I)> | 19.6 | |
Completeness [%] | 97.9 | 91.6 |
Redundancy | 2.8 | 2.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.3 | 276 | 16% PEG 4000, pH 7.3, VAPOR DIFFUSION, SITTING DROP, temperature 276K |