8J1W
A near-infrared fluorescent protein of de novo backbone design
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL18U1 |
Synchrotron site | SSRF |
Beamline | BL18U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-12-10 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9791 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 63.869, 50.138, 66.640 |
Unit cell angles | 90.00, 111.43, 90.00 |
Refinement procedure
Resolution | 27.480 - 1.950 |
R-factor | 0.1892 |
Rwork | 0.187 |
R-free | 0.24030 |
Structure solution method | SAD |
RMSD bond length | 0.006 |
RMSD bond angle | 0.823 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | AutoSol |
Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.019 |
High resolution limit [Å] | 1.950 | 1.950 |
Number of reflections | 14068 | 1345 |
<I/σ(I)> | 21.37 | |
Completeness [%] | 97.2 | |
Redundancy | 6.7 | |
CC(1/2) | 1.000 | 0.928 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 289 | 20% PEG 3350, 0.2 M K dihydrogen Phosphate |