7LM6
Crystal structure of the Zn(II)-bound AdcAII H205L mutant variant of Streptococcus pneumoniae
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 | 2017-04-11 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.954 |
Spacegroup name | P 65 2 2 |
Unit cell lengths | 119.792, 119.792, 169.503 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 49.619 - 3.367 |
R-factor | 0.2309 |
Rwork | 0.229 |
R-free | 0.24700 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3cx3 |
RMSD bond length | 0.003 |
RMSD bond angle | 0.528 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX ((1.14_3260: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 49.620 | 3.640 |
High resolution limit [Å] | 3.367 | 3.367 |
Rmerge | 0.192 | 0.581 |
Number of reflections | 10715 | 2118 |
<I/σ(I)> | 15 | |
Completeness [%] | 99.5 | |
Redundancy | 15.6 | |
CC(1/2) | 0.997 | 0.931 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.2 M zinc acetate, 20% (w/v) polyethylene glycol 3350 |