7K09
Puromycin N-acetyltransferase in complex with acetyl-CoA
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
Synchrotron site | Australian Synchrotron |
Beamline | MX2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-06-19 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.95372 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 149.074, 73.630, 106.242 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 106.240 - 2.313 |
R-factor | 0.2371 |
Rwork | 0.236 |
R-free | 0.25230 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2qec |
RMSD bond length | 0.010 |
RMSD bond angle | 1.060 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | MR-Rosetta |
Refinement software | BUSTER (2.10.3) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 106.242 | 2.589 |
High resolution limit [Å] | 2.361 | 2.361 |
Rmerge | 0.502 | |
Rmeas | 0.517 | |
Rpim | 0.125 | 0.795 |
Number of reflections | 27792 | 1192 |
<I/σ(I)> | 7.7 | 1.5 |
Completeness [%] | 93.1 | 67 |
Redundancy | 16.9 | 15.8 |
CC(1/2) | 0.994 | 0.504 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 9 | 281 | 2.5 M ammonium sulfate, 10% v/v DL-malate-MES-Tris pH 9.0 |