Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE MASSIF-1 |
Synchrotron site | ESRF |
Beamline | MASSIF-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-09-13 |
Detector | DECTRIS PILATUS3 2M |
Wavelength(s) | 0.966 |
Spacegroup name | I 1 2 1 |
Unit cell lengths | 53.339, 28.795, 63.004 |
Unit cell angles | 90.00, 96.93, 90.00 |
Refinement procedure
Resolution | 38.200 - 1.150 |
Rwork | 0.148 |
R-free | 0.18230 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2yxf |
RMSD bond length | 0.017 |
RMSD bond angle | 1.893 |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.200 | 1.170 |
High resolution limit [Å] | 1.150 | 1.150 |
Rpim | 0.031 | 0.916 |
Number of reflections | 33548 | 1614 |
<I/σ(I)> | 10.7 | 0.8 |
Completeness [%] | 98.6 | 98.4 |
Redundancy | 2.8 | 2.8 |
CC(1/2) | 0.998 | 0.504 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293.15 | 100 nL mother liquor / 200 nL protein 15% Glycerol, 0.1 M NaAcetate pH 4.5-5.5, 28-32%PEG 4000, 0.2 M NH4Acetate |