4MO4
Crystal structure of AnmK bound to AMPPCP
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CLSI BEAMLINE 08ID-1 |
Synchrotron site | CLSI |
Beamline | 08ID-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-03-22 |
Detector | RAYONIX MX-300 |
Wavelength(s) | 0.97949 |
Spacegroup name | P 1 |
Unit cell lengths | 59.657, 70.823, 91.211 |
Unit cell angles | 106.50, 104.93, 98.26 |
Refinement procedure
Resolution | 44.856 - 1.670 |
R-factor | 0.1788 |
Rwork | 0.177 |
R-free | 0.21330 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3qbw |
RMSD bond length | 0.007 |
RMSD bond angle | 1.160 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX ((phenix.refine: 1.8.1_1168)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 44.860 | 1.760 |
High resolution limit [Å] | 1.670 | 1.670 |
Rmerge | 0.050 | 0.593 |
Number of reflections | 151753 | |
<I/σ(I)> | 13.1 | 2 |
Completeness [%] | 97.2 | 95.2 |
Redundancy | 3.3 | 3.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 9 | 298 | 26% PEG4000, 0.2 M magnesium chloride, 0.1 M Tris, pH 9.0, VAPOR DIFFUSION, temperature 298K |