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5DE9

The role of Ile87 of CYP158A2 in oxidative coupling reaction

Replaces:  3TNK
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 21-ID-G
Synchrotron siteAPS
Beamline21-ID-G
Temperature [K]100
Detector technologyCCD
Collection date2010-11-10
DetectorMARMOSAIC 300 mm CCD
Wavelength(s)0.97
Spacegroup nameP 1 21 1
Unit cell lengths59.609, 79.313, 87.658
Unit cell angles90.00, 94.08, 90.00
Refinement procedure
Resolution29.372 - 1.760
R-factor0.1938
Rwork0.193
R-free0.24050
RMSD bond length0.015
RMSD bond angle1.802
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHASER
Refinement softwarePHENIX (1.9_1692)
Data quality characteristics
 Overall
Low resolution limit [Å]30.000
High resolution limit [Å]1.760
Number of reflections79247
<I/σ(I)>11
Completeness [%]98.3
Redundancy3.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.529515-25% PEG3350

222036

PDB entries from 2024-07-03

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