8H7H
The crystal structure of human abl1 kinase domain in complex with abl1-A-EBA
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL19U1 |
Synchrotron site | SSRF |
Beamline | BL19U1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2022-09-03 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.97 |
Spacegroup name | P 2 21 21 |
Unit cell lengths | 56.766, 104.777, 133.014 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 26.194 - 2.278 |
R-factor | 0.184642829412 |
Rwork | 0.182 |
R-free | 0.22055 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 7w7y |
RMSD bond length | 0.003 |
RMSD bond angle | 0.701 |
Data reduction software | HKL-3000 |
Data scaling software | XDS |
Phasing software | PHENIX |
Refinement software | PHENIX (1.9_1692+SVN) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.280 |
High resolution limit [Å] | 2.200 | 2.200 |
Number of reflections | 34902 | 34902 |
<I/σ(I)> | 17 | |
Completeness [%] | 99.9 | |
Redundancy | 7.4 | |
CC(1/2) | 0.992 | 0.983 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 1.5 M (NH4)2SO4, 0.1 M HEPES (pH 7.0) and 4% v/v 1,3-propanediol |