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7C2A

Crystal structure of AlinE4, a SGNH-hydrolase family esterase

Replaces:  6M43Replaces:  6IQ9
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRF BEAMLINE BL17U1
Synchrotron siteSSRF
BeamlineBL17U1
Temperature [K]80
Detector technologyCCD
Collection date2017-06-11
DetectorADSC QUANTUM 315r
Wavelength(s)0.97931
Spacegroup nameP 42 21 2
Unit cell lengths79.783, 79.783, 61.010
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution48.460 - 1.180
R-factor0.1765
Rwork0.176
R-free0.18270
Structure solution methodSAD
Starting model (for MR)4jgg
RMSD bond length0.009
RMSD bond angle1.064
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHENIX
Refinement softwarePHENIX (1.14_3247)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]48.4601.210
High resolution limit [Å]1.1801.180
Rmerge0.0730.645
Number of reflections646184370
<I/σ(I)>20
Completeness [%]99.0
Redundancy2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP291.151M Sodium acetate, 100mM HEPES, pH 7.5, 50mM Cadmium sulfate

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