Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL10U2 |
Synchrotron site | SSRF |
Beamline | BL10U2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2023-06-11 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.97853 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 52.239, 52.239, 203.458 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 36.340 - 1.650 |
R-factor | 0.2102 |
Rwork | 0.209 |
R-free | 0.22480 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 9iq7 |
RMSD bond length | 0.009 |
RMSD bond angle | 1.062 |
Data reduction software | autoPROC |
Data scaling software | autoPROC |
Phasing software | PHASER |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 36.340 | 1.710 |
High resolution limit [Å] | 1.650 | 1.650 |
Number of reflections | 32718 | 3433 |
<I/σ(I)> | 13.62 | |
Completeness [%] | 92.7 | |
Redundancy | 15.1 | |
CC(1/2) | 0.999 | 0.846 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 291.15 | 2.0 M Ammonium sulfate, 0.1 M Sodium HEPES 7.5, 2 % v/v PEG 400 |