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Structure paper

TitleTemperature-dependent spin crossover in neuronal nitric oxide synthase bound with the heme-coordinating thioether inhibitors.
Journal, issue, pagesJ. Am. Chem. Soc., Vol. 133, Page 8326-8334, Year 2011
Publish dateJan 7, 2011 (structure data deposition date)
AuthorsDoukov, T. / Li, H. / Sharma, A. / Martell, J.D. / Soltis, S.M. / Silverman, R.B. / Poulos, T.L.
External linksJ. Am. Chem. Soc. / PubMed:21534614
MethodsX-ray diffraction
Resolution2.15 - 2.24 Å
Structure data

PDB-3q99:
Structure of neuronal nitric oxide synthase in the ferric state in complex with N~5~-[(3-(ethylsulfanyl)propanimidoyl]-L-ornithine
Method: X-RAY DIFFRACTION / Resolution: 2.15 Å

PDB-3q9a:
Structure of neuronal nitric oxide synthase in the ferric state in complex with N-5-[2-(ethylsulfanyl)ethanimidoyl]-L-ornithine
Method: X-RAY DIFFRACTION / Resolution: 2.24 Å

Chemicals

ChemComp-HEM:
PROTOPORPHYRIN IX CONTAINING FE

ChemComp-JM8:
N~5~-[(3-(ethylsulfanyl)propanimidoyl]-L-ornithine

ChemComp-H4B:
5,6,7,8-TETRAHYDROBIOPTERIN / neurotransmitter*YM

ChemComp-ACT:
ACETATE ION

ChemComp-ZN:
Unknown entry

ChemComp-HOH:
WATER

ChemComp-JM7:
N~5~-[2-(ethylsulfanyl)ethanimidoyl]-L-ornithine

Source
  • rattus norvegicus (Norway rat)
KeywordsOxidoreductase/oxidoreductase inhibitor / nitric oxide synthase / heme enzyme / oxidoreductase / inhibitor / Oxidoreductase-oxidoreductase inhibitor complex

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