2XVD
ephB4 kinase domain inhibitor complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-09-13 |
Detector | RIGAKU CCD |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 46.708, 53.315, 61.330 |
Unit cell angles | 90.00, 111.75, 90.00 |
Refinement procedure
Resolution | 43.050 - 1.700 |
R-factor | 0.17687 |
Rwork | 0.175 |
R-free | 0.20913 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2vwu |
RMSD bond length | 0.015 |
RMSD bond angle | 1.436 |
Data reduction software | d*TREK |
Data scaling software | d*TREK |
Phasing software | AMoRE |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 43.000 | 1.760 |
High resolution limit [Å] | 1.700 | 1.700 |
Rmerge | 0.050 | 0.360 |
Number of reflections | 28154 | |
<I/σ(I)> | 14.3 | 2 |
Completeness [%] | 90.9 | 46.9 |
Redundancy | 3.32 | 2.06 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.5 | PH 7.5 |