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9HE3

Crystal structure of human tryptophan hydroxylase 1 in complex with inhibitor LP778902

This is a non-PDB format compatible entry.
Replaces:  7ZIK
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsBESSY BEAMLINE 14.1
Synchrotron siteBESSY
Beamline14.1
Temperature [K]100
Detector technologyPIXEL
Collection date2015-10-23
DetectorDECTRIS PILATUS 6M
Wavelength(s)0.9184
Spacegroup nameP 1
Unit cell lengths47.090, 57.581, 62.587
Unit cell angles107.65, 93.14, 90.15
Refinement procedure
Resolution47.010 - 2.589
R-factor0.230665399004
Rwork0.229
R-free0.25864
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.002
RMSD bond angle0.668
Data reduction softwareXDS
Data scaling softwareXDS
Phasing softwarePHASER
Refinement softwarePHENIX (1.9_1692)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]47.0102.682
High resolution limit [Å]2.5892.589
Rmerge0.1840.789
Number of reflections189841763
<I/σ(I)>6.77
Completeness [%]97.5
Redundancy3.5
CC(1/2)0.9830.671
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP293.1527% w/v PEG 3350, 0.1 M Bis-Tris pH 6.5

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