5MU8
HUMAN TNF-ALPHA IN COMPLEX WITH JNJ525
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X6A |
| Synchrotron site | NSLS |
| Beamline | X6A |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-08-17 |
| Detector | DECTRIS PILATUS3 S 6M |
| Wavelength(s) | 1.0000 |
| Spacegroup name | P 1 |
| Unit cell lengths | 104.888, 118.348, 186.747 |
| Unit cell angles | 97.57, 94.31, 98.75 |
Refinement procedure
| Resolution | 184.240 - 3.000 |
| R-factor | 0.21131 |
| Rwork | 0.211 |
| R-free | 0.30000 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.448 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 184.240 | 3.250 |
| High resolution limit [Å] | 3.000 | 3.000 |
| Rmerge | 0.068 | 0.677 |
| Number of reflections | 158847 | |
| <I/σ(I)> | 7.58 | |
| Completeness [%] | 90.6 | 90.4 |
| Redundancy | 1.9 | 1.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | PEG |
