7ZIF
Crystal structure of human tryptophan hydroxylase 1 in complex with inhibitor KM-480
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 | 2014-01-28 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9184 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 47.021, 57.919, 59.416 |
Unit cell angles | 90.00, 97.65, 90.00 |
Refinement procedure
Resolution | 41.293 - 1.869 |
R-factor | 0.161484691984 |
Rwork | 0.160 |
R-free | 0.19881 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1mlw |
RMSD bond length | 0.010 |
RMSD bond angle | 1.260 |
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] | 41.293 | 1.940 |
High resolution limit [Å] | 1.869 | 1.870 |
Rmerge | 0.070 | 0.443 |
Number of reflections | 26286 | 2564 |
<I/σ(I)> | 14.53 | |
Completeness [%] | 99.8 | 98.69 |
Redundancy | 4.1 | 3.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293.15 | 8% w/v PEG 8000, 100 mM Tris-HCl pH 8.5 |