6TTJ
Neutral invertase 2 from Arabidopsis thaliana
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID30B |
Synchrotron site | ESRF |
Beamline | ID30B |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-11-21 |
Detector | DECTRIS EIGER X 9M |
Wavelength(s) | 0.98 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 107.450, 186.708, 152.200 |
Unit cell angles | 90.00, 104.86, 90.00 |
Refinement procedure
Resolution | 46.654 - 3.392 |
R-factor | 0.2537 |
Rwork | 0.252 |
R-free | 0.28380 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5goo |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | MOLREP |
Refinement software | PHENIX (1.15.2_3472) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 49.000 | 3.460 |
High resolution limit [Å] | 3.390 | 3.390 |
Rmerge | 0.415 | 1.698 |
Number of reflections | 79402 | 4000 |
<I/σ(I)> | 4.8 | 1.2 |
Completeness [%] | 99.0 | 87.6 |
Redundancy | 3.7 | 3.3 |
CC(1/2) | 0.950 | 0.852 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 9 | 298 | 2.9 M NaCl, 9% polyethylene glycol 4000, 0.1 M bicine, pH 9.0 |