4AW5
Complex of the EphB4 kinase domain with an oxindole inhibitor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 32-ID |
Synchrotron site | APS |
Beamline | 32-ID |
Temperature [K] | 93.2 |
Detector technology | CCD |
Collection date | 2002-10-25 |
Detector | MARRESEARCH |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 46.657, 53.978, 63.242 |
Unit cell angles | 90.00, 111.06, 90.00 |
Refinement procedure
Resolution | 58.720 - 2.330 |
R-factor | 0.19439 |
Rwork | 0.190 |
R-free | 0.27894 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | IN-HOUSE APO STRUCTURE |
RMSD bond length | 0.019 |
RMSD bond angle | 1.938 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.1.24) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 54.000 | 2.460 |
High resolution limit [Å] | 2.330 | 2.330 |
Rmerge | 0.120 | 0.460 |
Number of reflections | 12716 | |
<I/σ(I)> | 11.4 | 1.8 |
Completeness [%] | 100.0 | 100 |
Redundancy | 3.7 | 3.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 8 | pH 8.0 |