6QGJ
Structure of human Bcl-2 in complex with fragment/ABT-263 hybrid
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RUH3R |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2009-06-10 |
| Detector | RIGAKU RAXIS IV++ |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 44.989, 56.173, 64.417 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 10.000 - 1.900 |
| R-factor | 0.202 |
| Rwork | 0.201 |
| R-free | 0.22480 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6qgg |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.903 |
| Data reduction software | CrystalClear |
| 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] | 30.000 | 30.000 | 1.810 |
| High resolution limit [Å] | 1.750 | 3.770 | 1.750 |
| Rmerge | 0.034 | 0.020 | 0.539 |
| Total number of observations | 66248 | ||
| Number of reflections | 16972 | 1738 | 1634 |
| <I/σ(I)> | 19.5 | ||
| Completeness [%] | 99.1 | 94.1 | 98 |
| Redundancy | 3.9 | 3.6 | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 284 | 0.15M KSCN, 20% PEG1500 and 0.1M Na acetate buffer pH 5.5 |
