7ZIK
Crystal structure of human tryptophan hydroxylase 1 in complex with inhibitor LP533401
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | BESSY BEAMLINE 14.1 |
| Synchrotron site | BESSY |
| Beamline | 14.1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-10-23 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9184 |
| Spacegroup name | P 1 |
| Unit cell lengths | 47.090, 57.581, 62.587 |
| Unit cell angles | 107.65, 93.14, 90.15 |
Refinement procedure
| Resolution | 47.010 - 2.589 |
| R-factor | 0.225314747862 |
| Rwork | 0.224 |
| R-free | 0.25907 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3hf8 |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.714 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.010 | 2.680 |
| High resolution limit [Å] | 2.589 | 2.590 |
| Rmerge | 0.184 | 0.789 |
| Number of reflections | 18984 | 1763 |
| <I/σ(I)> | 6.77 | |
| Completeness [%] | 97.5 | |
| Redundancy | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293.15 | 27% w/v PEG 3350, 0.1 M Bis-Tris pH 6.5 |
