6JH7
Crystal structure of AerF from Microcystis aeruginosa
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U1 |
Synchrotron site | SSRF |
Beamline | BL17U1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2014-12-15 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.97907 |
Spacegroup name | P 43 2 2 |
Unit cell lengths | 101.581, 101.581, 116.094 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 45.000 - 1.380 |
R-factor | 0.14272 |
Rwork | 0.141 |
R-free | 0.16639 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3u49 |
RMSD bond length | 0.005 |
RMSD bond angle | 1.127 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.000 | 1.400 |
High resolution limit [Å] | 1.380 | 1.380 |
Rmerge | 0.083 | 0.906 |
Rpim | 0.023 | 0.301 |
Number of reflections | 122470 | 5628 |
<I/σ(I)> | 33.9 | 3.3 |
Completeness [%] | 98.5 | 92.1 |
Redundancy | 13.7 | 9.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 285 | 0.2 M Calcium Chloride, 0.1 M HEPES sodium pH 7.0, 23% (v/v) polyethylene glycol 400 |