6OIP
Crystal structure of MYST acetyltransferase domain in complex with inhibitor 34
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
Synchrotron site | Australian Synchrotron |
Beamline | MX2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-06-10 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.9537 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 46.400, 55.920, 123.950 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 34.313 - 1.800 |
R-factor | 0.1865 |
Rwork | 0.185 |
R-free | 0.22190 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2pq8 |
RMSD bond length | 0.007 |
RMSD bond angle | 0.977 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX ((1.13_2998)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 34.313 | 1.864 |
High resolution limit [Å] | 1.800 | 1.800 |
Number of reflections | 30658 | 3054 |
<I/σ(I)> | 13.4 | 4 |
Completeness [%] | 99.9 | 100 |
Redundancy | 6.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 292 | 20% PEG 3350, 0.2 M K/Na Tartrate |