5D4N
Structure of CPII bound to ADP, AMP and acetate, from Thiomonas intermedia K12
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-C |
Synchrotron site | APS |
Beamline | 24-ID-C |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-03-07 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.97920 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 51.530, 75.410, 79.550 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 54.730 - 1.600 |
R-factor | 0.2127 |
Rwork | 0.211 |
R-free | 0.23460 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5d4l |
RMSD bond length | 0.010 |
RMSD bond angle | 1.110 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER (2.5.7) |
Refinement software | BUSTER-TNT (2.10.0) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 54.730 | 1.640 | |
High resolution limit [Å] | 1.600 | 7.150 | 1.600 |
Rmerge | 0.038 | 0.022 | 0.852 |
Rmeas | 0.041 | 0.024 | 0.927 |
Total number of observations | 267556 | ||
Number of reflections | 41577 | 544 | 2984 |
<I/σ(I)> | 21.38 | 59.77 | 1.91 |
Completeness [%] | 99.5 | 100 | 97.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | EVAPORATION | 5.9 | 298 | 0.1 M acetate pH 4.6, 30% PEG 2000, 0.2 M Ammonium sulfate |