6QGG
Structure of human Bcl-2 in complex with analogue of ABT-737
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-08-07 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.97 |
Spacegroup name | P 41 |
Unit cell lengths | 55.277, 55.277, 58.593 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 15.000 - 1.500 |
R-factor | 0.152 |
Rwork | 0.151 |
R-free | 0.17320 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2yxj |
RMSD bond length | 0.019 |
RMSD bond angle | 1.908 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0230) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.540 |
High resolution limit [Å] | 1.490 | 3.210 | 1.490 |
Rmerge | 0.059 | 0.043 | 0.196 |
Total number of observations | 110813 | ||
Number of reflections | 27361 | 2486 | 2685 |
<I/σ(I)> | 14.3 | ||
Completeness [%] | 94.7 | 84 | 94.9 |
Redundancy | 4.1 | 4 | 3.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.6 | 284 | 1.4M Na/K phosphate pH 5.6 |