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2FC2

NO-HEME complex in a bacterial nitric oxide synthase. An Fe(III)-NO may cause nitrosation.

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsCHESS BEAMLINE F1
Synchrotron siteCHESS
BeamlineF1
Temperature [K]100
Detector technologyCCD
DetectorADSC QUANTUM 4
Spacegroup nameP 21 21 2
Unit cell lengths82.738, 96.175, 129.547
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution27.020 - 2.200
R-factor0.25936
Rwork0.273
R-free0.27357
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.021
RMSD bond angle2.182
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareREFMAC (5.2.0005)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.000
High resolution limit [Å]2.2002.200
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.5298Peg8k, 5-10 K, K acetate, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K
1VAPOR DIFFUSION, HANGING DROP6.5298Peg8k, 5-10 K, K acetate, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K

219869

PDB entries from 2024-05-15

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