8HZ1
Ambient temperature crystal structure of Escherichia coli CyaY
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU PhotonJet-R |
Temperature [K] | 298 |
Detector technology | PIXEL |
Collection date | 2022-09-14 |
Detector | RIGAKU HyPix-3000 |
Wavelength(s) | 1.54 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 45.167, 45.167, 101.129 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 30.940 - 2.000 |
R-factor | 0.3197 |
Rwork | 0.316 |
R-free | 0.35590 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1ew4 |
RMSD bond length | 0.002 |
RMSD bond angle | 0.448 |
Data reduction software | CrysalisPro (1.171.42.35a) |
Data scaling software | CrysalisPro (1.171.42.35a) |
Phasing software | PHASER (2.8.3) |
Refinement software | PHENIX (1.20.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 31.040 | 2.070 |
High resolution limit [Å] | 1.990 | 2.000 |
Number of reflections | 7996 | 2934 |
<I/σ(I)> | 5.88 | |
Completeness [%] | 93.3 | |
Redundancy | 1.9 | |
CC(1/2) | 0.877 | 0.221 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 4 | 277 | 0.1 M Citric acid, 4.0 M Sodium chloride (pH 4.0) |