4AQ3
HUMAN BCL-2 WITH PHENYLACYLSULFONAMIDE INHIBITOR
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-1 |
Synchrotron site | ESRF |
Beamline | ID23-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-02-17 |
Detector | ADSC QUANTUM 315 |
Spacegroup name | P 32 |
Unit cell lengths | 115.214, 115.214, 102.318 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 100.000 - 2.400 |
R-factor | 0.203 |
Rwork | 0.201 |
R-free | 0.24494 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | INTERNAL STRUCTURE |
RMSD bond length | 0.013 |
RMSD bond angle | 1.884 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.000 | 2.490 |
High resolution limit [Å] | 2.400 | 2.400 |
Rmerge | 0.080 | 0.580 |
Number of reflections | 58071 | |
<I/σ(I)> | 14.2 | 1.8 |
Completeness [%] | 97.8 | 88.7 |
Redundancy | 3.4 | 2.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 |