7OYJ
Crystal structure of hTEAD2 in complex with fragment at the interface 2
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE MASSIF-1 |
Synchrotron site | ESRF |
Beamline | MASSIF-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-04-18 |
Detector | DECTRIS PILATUS3 2M |
Wavelength(s) | 0.965459 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 113.507, 61.294, 80.224 |
Unit cell angles | 90.00, 111.22, 90.00 |
Refinement procedure
Resolution | 53.040 - 1.910 |
R-factor | 0.1968 |
Rwork | 0.196 |
R-free | 0.22170 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5dq8 |
Data reduction software | xia2 |
Data scaling software | xia2 |
Refinement software | PHENIX (1.19.1-4122) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 74.786 | 74.786 | 1.794 |
High resolution limit [Å] | 1.592 | 5.091 | 1.592 |
Rmerge | 0.033 | 0.025 | 0.537 |
Rmeas | 0.042 | 0.032 | 0.665 |
Rpim | 0.025 | 0.020 | 0.386 |
Total number of observations | 5033 | 5339 | |
Number of reflections | 65881 | 2128 | 2129 |
<I/σ(I)> | 14.8 | 40.8 | 1.6 |
Completeness [%] | 91.8 | 97.1 | 65.4 |
Redundancy | 2.4 | 2.4 | 2.5 |
CC(1/2) | 0.998 | 0.995 | 0.713 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 298 | 2.8M sodium formate |