6JQZ
ZHD/H242A complex with ZEN
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U1 |
Synchrotron site | SSRF |
Beamline | BL17U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-04-19 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.97916 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 74.680, 91.380, 113.000 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 35.000 - 2.090 |
R-factor | 0.17226 |
Rwork | 0.171 |
R-free | 0.20343 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5c8z |
RMSD bond length | 0.011 |
RMSD bond angle | 1.575 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 113.000 | 2.140 |
High resolution limit [Å] | 2.090 | 2.090 |
Rmerge | 0.094 | 0.652 |
Rpim | 0.056 | 0.387 |
Number of reflections | 46691 | 3407 |
<I/σ(I)> | 19.2 | |
Completeness [%] | 99.9 | |
Redundancy | 7.2 | |
CC(1/2) | 0.998 | 0.925 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | ammonium phosphate, imidazole, potassium chloride |