3OPM
Crystal Structure of Human DPP4 Bound to TAK-294
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 5.0.3 |
| Synchrotron site | ALS |
| Beamline | 5.0.3 |
| Temperature [K] | 92 |
| Detector technology | CCD |
| Collection date | 2007-03-09 |
| Detector | ADSC QUANTUM 315r |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 121.771, 122.557, 144.737 |
| Unit cell angles | 90.00, 115.00, 90.00 |
Refinement procedure
| Resolution | 35.000 - 2.720 |
| R-factor | 0.19749 |
| Rwork | 0.195 |
| R-free | 0.25447 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.217 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.770 |
| High resolution limit [Å] | 2.720 | 2.720 |
| Rmerge | 0.114 | 0.590 |
| Number of reflections | 100745 | |
| <I/σ(I)> | 8 | |
| Completeness [%] | 97.5 | 82.7 |
| Redundancy | 4.1 | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 277 | 23.6% PEG MME 2000, 100 mM Bicine, VAPOR DIFFUSION, SITTING DROP, temperature 277K |
