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4NBA

Carbazole-bound oxygenase with Ile262 replaced by Val and ferredoxin complex of carbazole 1,9a-dioxygenase

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL38B1
Synchrotron siteSPring-8
BeamlineBL38B1
Temperature [K]100
Detector technologyCCD
Collection date2005-12-10
DetectorRIGAKU JUPITER 210
Wavelength(s)1.0
Spacegroup nameP 1 21 1
Unit cell lengths98.287, 89.988, 105.258
Unit cell angles90.00, 104.11, 90.00
Refinement procedure
Resolution32.790 - 2.100
R-factor0.19
Rwork0.190
R-free0.21700
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2de5
RMSD bond length0.006
RMSD bond angle1.300
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareMOLREP
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.180
High resolution limit [Å]2.1002.100
Number of reflections103638
Completeness [%]100.0100
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP5.52930.1M ammonium acetate, 12.5% PEG 3350, 0.05M MES, pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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