7WGM
Crystal structure of Adenosine triphosphate phosphoribosyltransferase (HisG) from Acinetobacter baumannii at 3.15 A resolution
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-2 |
Synchrotron site | ESRF |
Beamline | ID23-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-11-17 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.873 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 73.865, 79.645, 98.881 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 62.027 - 3.150 |
Rwork | 0.215 |
R-free | 0.27090 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5m8h |
RMSD bond length | 0.006 |
RMSD bond angle | 1.533 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 62.030 | 3.200 |
High resolution limit [Å] | 3.150 | 3.150 |
Rmerge | 0.137 | |
Number of reflections | 10564 | 513 |
<I/σ(I)> | 15.8 | 2.2 |
Completeness [%] | 99.6 | 100 |
Redundancy | 15.1 | 15 |
CC(1/2) | 0.999 | 0.782 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 298 | 0.1M Sodium acetate trihydrate (pH 4.6), 2M Sodium formate |