4BEL
BACE2 XAPERONE COMPLEX
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2011-09-13 |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 63.027, 61.757, 115.620 |
| Unit cell angles | 90.00, 101.38, 90.00 |
Refinement procedure
| Resolution | 43.680 - 1.850 |
| R-factor | 0.18336 |
| Rwork | 0.181 |
| R-free | 0.22234 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3zkq |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.324 |
| Data reduction software | XDS |
| Data scaling software | SADABS |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.680 | 1.950 |
| High resolution limit [Å] | 1.850 | 1.850 |
| Rmerge | 0.100 | 0.620 |
| Number of reflections | 70362 | |
| <I/σ(I)> | 8.34 | 1.11 |
| Completeness [%] | 94.3 | 68.5 |
| Redundancy | 3.42 | 1.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.5 | 50MM MGCL2, 30% MME 550, 100MM HEPES PH 7.5 |
