8R9O
A soakable crystal form of human CDK7 in complex with AMP-PNP
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 | 2020-09-24 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.9999 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 40.138, 123.739, 142.197 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 56.730 - 2.220 |
R-factor | 0.2581 |
Rwork | 0.253 |
R-free | 0.34430 |
Structure solution method | FOURIER SYNTHESIS |
RMSD bond length | 0.012 |
RMSD bond angle | 1.120 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | BUSTER |
Refinement software | BUSTER (2.11.8 (16-JUL-2021)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 56.730 | 2.270 |
High resolution limit [Å] | 2.220 | 2.220 |
Rmeas | 0.252 | 0.730 |
Number of reflections | 15530 | 775 |
<I/σ(I)> | 5.3 | 1.7 |
Completeness [%] | 84.4 | |
Redundancy | 4.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 277 | 0.1M (NH4)3 citrate 15% PEG 3350 |