Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL45XU |
Synchrotron site | SPring-8 |
Beamline | BL45XU |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2024-07-15 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.99999 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 45.400, 164.933, 56.588 |
Unit cell angles | 90.00, 111.84, 90.00 |
Refinement procedure
Resolution | 44.302 - 2.000 |
Rwork | 0.188 |
R-free | 0.23780 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.004 |
RMSD bond angle | 1.281 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0425) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 44.302 | 2.050 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.144 | 1.085 |
Number of reflections | 50921 | 3701 |
<I/σ(I)> | 10 | |
Completeness [%] | 98.0 | |
Redundancy | 7.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | HM(PEGs-E9)-D6 (0.18M NH4Cl, 24% PEG 3350) |