5W5R
Agrobacterium tumefaciens ADP-glucose pyrophosphorylase P96A mutant bound to activator pyruvate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-ID |
Synchrotron site | APS |
Beamline | 19-ID |
Temperature [K] | 77 |
Detector technology | CCD |
Collection date | 2015-03-15 |
Detector | MARRESEARCH |
Wavelength(s) | 0.98 |
Spacegroup name | P 1 |
Unit cell lengths | 93.400, 140.993, 228.209 |
Unit cell angles | 72.00, 78.18, 90.01 |
Refinement procedure
Resolution | 46.884 - 1.754 |
R-factor | 0.2022 |
Rwork | 0.201 |
R-free | 0.22800 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.004 |
RMSD bond angle | 0.801 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.780 |
High resolution limit [Å] | 1.750 | 4.750 | 1.750 |
Rmerge | 0.066 | 0.031 | 0.547 |
Rmeas | 0.093 | 0.044 | 0.772 |
Rpim | 0.066 | 0.031 | 0.544 |
Total number of observations | 2012923 | ||
Number of reflections | 1029422 | ||
<I/σ(I)> | 8.4 | ||
Completeness [%] | 95.4 | 85.9 | 95.8 |
Redundancy | 2 | 1.9 | 2 |
CC(1/2) | 0.995 | 0.672 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 50 mM Hepes, 1.5 M lithium sulfate at pH 7.5 |