5Z4M
Structure of TailorD343A with bound UTP and Mg
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL19U1 |
Synchrotron site | SSRF |
Beamline | BL19U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-11-25 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.9785 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 61.962, 84.556, 149.347 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 30.981 - 1.740 |
R-factor | 0.1692 |
Rwork | 0.167 |
R-free | 0.20610 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4nkt |
RMSD bond length | 0.010 |
RMSD bond angle | 1.043 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | PHENIX ((1.10_2155: ???)) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.770 |
High resolution limit [Å] | 1.740 | 4.720 | 1.740 |
Rmerge | 0.071 | 0.046 | 0.590 |
Rmeas | 0.074 | 0.048 | 0.617 |
Rpim | 0.020 | 0.014 | 0.175 |
Number of reflections | 40441 | 2164 | 1964 |
<I/σ(I)> | 6.3 | ||
Completeness [%] | 99.7 | 98.9 | 98.9 |
Redundancy | 12.9 | 12.3 | 11.5 |
CC(1/2) | 0.998 | 0.946 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 277 | 0.2M Sodium chloride, 0.1M Tris pH 8.4, 15% w/v PEG 3350 |