6T16
ASR Alternansucrase in complex with panose
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-1 |
Synchrotron site | ESRF |
Beamline | ID23-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-04-04 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9979 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 101.001, 134.304, 235.375 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 117.690 - 3.100 |
R-factor | 0.2244 |
Rwork | 0.223 |
R-free | 0.25310 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6hvg |
RMSD bond length | 0.010 |
RMSD bond angle | 1.282 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 117.690 | 3.270 |
High resolution limit [Å] | 3.100 | 3.100 |
Rmerge | 0.104 | 0.781 |
Number of reflections | 58714 | 41304 |
<I/σ(I)> | 6.7 | |
Completeness [%] | 99.7 | 99.8 |
Redundancy | 4.7 | |
CC(1/2) | 0.998 | 0.779 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 285 | PEG3350 14% 0.4M NaNO3 |