Brand  (β version)

PDB ID: 4D3M

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Ligands
Code Name Style Show Link
CL Chloride ion PoSSuM
GOL Glycerol PoSSuM
HEM Protoporphyrin ix containing Fe PoSSuM
IVU 3-[2-(6-amino-4-methylpyridin-2-yl)ethyl]-5-{2-[4-methyl-6-(methylamino)pyridin-2-yl]ethyl}benzonitrile PoSSuM
POL N-propanol PoSSuM
Non-standard Residues
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Structure summary

Code : 4D3M   PDBj   RCSB PDB   PDBe
Header : OXIDOREDUCTASE
Title : Structure of Bacillus subtilis Nitric Oxide Synthase in complex with 3-(2-(6-Amino-4-methylpyridin-2-yl)ethyl)-5-(2-(4-methyl-6-(methylamino)pyridin-2-yl)ethyl)benzonitrile
Release Data : 2015-01-14
Compound :
mol_id molecule chains synonym
1 NITRIC OXIDE SYNTHASE OXYGENASE A NOSOXY-LIKE PROTEIN
ec: 1.14.13.165
mutation: YES
Source :
mol_id organism_scientific expression_system
1 BACILLUS SUBTILIS SUBSP. SUBTILIS STR. 168  (taxid:224308) ESCHERICHIA COLI  (taxid:469008)
atcc: 23857
expression_system_strain: BL21(DE3)
expression_system_vector_type: PLASMID
expression_system_vector: PET28A
Authors : Holden, J.K., Poulos, T.L.
Keywords : OXIDOREDUCTASE, INHIBITOR
Exp. method : X-RAY DIFFRACTION ( 1.741 Å )
Citation :

Structure-based design of bacterial nitric oxide synthase inhibitors.

Holden, J.K.,Kang, S.,Hollingsworth, S.A.  et al.
(2015)  J. Med. Chem.  58 : 994 - 1004

PubMed: 25522110
DOI: 10.1021/jm501723p

Reaction

Chain : A
UniProt : O34453 (NOSO_BACSU)
Reaction: EC: Evidence:
Physiological Direction:
2 L-arginine + 4 O2 + 3 reduced [flavodoxin] = 5 H(+) + 4 H2O + 2 L-citrulline + 2 nitric oxide + 3 oxidized [flavodoxin] 1.14.14.47 PubMed:11856757
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