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8X6Z

1-naphthylamine GS from Pseudomonas sp. JS3066

This is a non-PDB format compatible entry.
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRF BEAMLINE BL19U1
Synchrotron siteSSRF
BeamlineBL19U1
Temperature [K]110
Detector technologyPIXEL
Collection date2021-07-13
DetectorDECTRIS PILATUS3 6M
Wavelength(s)0.97915
Spacegroup nameP 21 21 21
Unit cell lengths121.635, 140.141, 218.775
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution19.980 - 2.950
R-factor0.2249
Rwork0.224
R-free0.24690
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.009
RMSD bond angle1.167
Data reduction softwareXDS
Data scaling softwareXDS
Phasing softwarePHASER
Refinement softwarePHENIX ((1.20.1_4487: ???))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]19.9803.010
High resolution limit [Å]2.9502.950
Number of reflections790654423
<I/σ(I)>9.4
Completeness [%]99.6
Redundancy7.1
CC(1/2)0.9890.762
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP2983.2 M Sodium chloride, 0.1 M BIS-TRIS propane pH 7.0

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