5AR8
RIP2 Kinase Catalytic Domain (1 - 310) complex with Biphenylsulfonamide
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 | PIXEL |
| Collection date | 2009-09-30 |
| Detector | DECTRIS PIXEL |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 132.371, 132.371, 107.424 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 33.680 - 2.790 |
| R-factor | 0.2043 |
| Rwork | 0.203 |
| R-free | 0.23270 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5ar4 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.160 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | REFMAC |
| Refinement software | BUSTER (2.11.5) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.000 | 2.830 |
| High resolution limit [Å] | 2.780 | 2.780 |
| Rmerge | 0.060 | 0.430 |
| Number of reflections | 27404 | |
| <I/σ(I)> | 24.7 | 3.5 |
| Completeness [%] | 99.3 | 100 |
| Redundancy | 5.5 | 5.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 4.6 | 30% GLYCEROL, 0.07M NA OAC PH4.6, 1.4M NA FORMATE |
