6RH0
Revisiting pH-gated conformational switch. Complex HK853-RR468 pH 5.5
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALBA BEAMLINE XALOC |
Synchrotron site | ALBA |
Beamline | XALOC |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-02-13 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.979178 |
Spacegroup name | I 1 2 1 |
Unit cell lengths | 68.616, 92.933, 174.337 |
Unit cell angles | 90.00, 93.49, 90.00 |
Refinement procedure
Resolution | 49.210 - 2.870 |
R-factor | 0.24271 |
Rwork | 0.240 |
R-free | 0.28727 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | PDB 3DGE |
RMSD bond length | 0.007 |
RMSD bond angle | 1.022 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 49.210 | 3.030 |
High resolution limit [Å] | 2.870 | 2.870 |
Number of reflections | 24443 | 3582 |
<I/σ(I)> | 14.1 | |
Completeness [%] | 97.6 | |
Redundancy | 3.8 | |
CC(1/2) | 0.998 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 294 | 1,5 M HH4SO4, 0,1M bis-tris 5,5 |