8C75
PBP AccA from A. tumefaciens Bo542 in apoform 3
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SOLEIL BEAMLINE PROXIMA 2 |
Synchrotron site | SOLEIL |
Beamline | PROXIMA 2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-02-07 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.98011 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 46.990, 182.075, 58.606 |
Unit cell angles | 90.00, 94.09, 90.00 |
Refinement procedure
Resolution | 49.190 - 1.673 |
R-factor | 0.2212 |
Rwork | 0.219 |
R-free | 0.25590 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.010 |
RMSD bond angle | 1.090 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | BUSTER (2.10.4) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 49.190 | 1.710 |
High resolution limit [Å] | 1.660 | 1.660 |
Rmerge | 0.111 | 1.117 |
Number of reflections | 113578 | 7440 |
<I/σ(I)> | 9.3 | |
Completeness [%] | 74.0 | |
Redundancy | 5 | |
CC(1/2) | 0.997 | 0.440 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 292 | PEG 4000, AcNH4, Na citrate |