9IID
Crystal structure of PgAfp
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U |
Synchrotron site | SSRF |
Beamline | BL17U |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2019-07-30 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.979 |
Spacegroup name | H 3 |
Unit cell lengths | 61.760, 61.760, 42.000 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 22.560 - 1.780 |
R-factor | 0.1741 |
Rwork | 0.172 |
R-free | 0.21600 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.006 |
RMSD bond angle | 0.938 |
Data reduction software | DIALS |
Data scaling software | DIALS |
Phasing software | PHASER |
Refinement software | PHENIX ((1.20.1_4487: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 22.560 | 1.844 |
High resolution limit [Å] | 1.780 | 1.780 |
Number of reflections | 5627 | 489 |
<I/σ(I)> | 57.92 | |
Completeness [%] | 98.1 | |
Redundancy | 8.3 | |
CC(1/2) | 0.999 | 0.997 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 289 | pH8.0, 3.2 M ammonium sulfate |