6YV4
STRUCTURE OF THE WNT DEACYLASE NOTUM IN COMPLEX WITH A PYRROLE-3-CARBOXYLIC ACID FRAGMENT 686
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I24 |
Synchrotron site | Diamond |
Beamline | I24 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-09-29 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.9686 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 59.240, 73.460, 79.380 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.480 - 2.000 |
R-factor | 0.1839 |
Rwork | 0.181 |
R-free | 0.23270 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4uz1 |
RMSD bond length | 0.011 |
RMSD bond angle | 1.096 |
Data reduction software | xia2 |
Data scaling software | DIALS |
Phasing software | PHASER |
Refinement software | PHENIX (dev_3699) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 73.450 | 1.750 |
High resolution limit [Å] | 1.720 | 1.720 |
Rmeas | 0.095 | 1.576 |
Number of reflections | 37517 | 1833 |
<I/σ(I)> | 13.4 | 1.2 |
Completeness [%] | 100.0 | 99.6 |
Redundancy | 12.3 | 12.9 |
CC(1/2) | 1.000 | 0.900 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 4 | 295 | 1.4 M AMMONIUM SULPHATE, 0.1 M CITRIC ACID, PH 4.0 |