4YC0
Crystal structure of ADP-ribosyltransferase Vis in complex with M6 Inhibitor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CLSI BEAMLINE 08ID-1 |
Synchrotron site | CLSI |
Beamline | 08ID-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-12-12 |
Detector | RAYONIX MX-300 |
Wavelength(s) | 0.979 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 48.230, 52.160, 101.600 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 46.400 - 1.500 |
R-factor | 0.1593 |
Rwork | 0.158 |
R-free | 0.18030 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4y1w |
RMSD bond length | 0.008 |
RMSD bond angle | 0.927 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX ((1.10_2155)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.400 | 1.554 |
High resolution limit [Å] | 1.500 | 1.500 |
Number of reflections | 69774 | |
<I/σ(I)> | 13.04 | |
Completeness [%] | 100.0 | 100 |
Redundancy | 7.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 297.15 | 30% Jeffamine ED-2001, 0.1 M Hepes |