7VKH
Crystal structure of AF9 YEATS domain in complex with hit 2
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL18U1 |
Synchrotron site | SSRF |
Beamline | BL18U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-12-29 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.9774 |
Spacegroup name | P 1 |
Unit cell lengths | 31.652, 41.426, 59.725 |
Unit cell angles | 102.00, 90.87, 90.36 |
Refinement procedure
Resolution | 31.650 - 2.250 |
R-factor | 0.2081 |
Rwork | 0.206 |
R-free | 0.24450 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4tmp |
Data reduction software | HKL-2000 |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX (1.16) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.000 | 2.290 |
High resolution limit [Å] | 2.250 | 2.250 |
Rmerge | 0.110 | 0.381 |
Number of reflections | 13767 | 13767 |
<I/σ(I)> | 9.26 | |
Completeness [%] | 97.6 | |
Redundancy | 3.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.2 M trimethylamine N-oxide dehydrate, 0.1 M Tris, 20% w/v PEGMME 2000, pH 8.5 |