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MolNFT v1 · #136279 · protein

Structure of rat neuronal nitric oxide synthase heme domain in complex with (rs)-3-[(2-amino-4-methylquinolin-7-YL)METHOXY]-5-(2- (METHYLAMINO)PROPYL)BENZONITRILE

5UNY: “Structure of rat neuronal nitric oxide synthase heme domain in complex with…”. X-ray diffraction, 5 ligands (HEM, H4B, M4R). MolNFT v1 #136279 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5UNY
Type
protein
Length
821 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P29476
Ligands
HEM, H4B, M4R, 8FD, ZN

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein410—P29476
B—protein411—P29476

Ligands and binding sites

  • HEM · Protoporphyrin IX containing Fe · ligand · 2 copies · chains A, B
  • H4B · 5,6,7,8-tetrahydrobiopterin · ligand · 2 copies · chains A, B
  • M4R · 3-[(2-amino-4-methylquinolin-7-yl)methoxy]-5-[(2R)-2-(methylamino)propyl]benzonitrile · ligand · 2 copies · chains A, B
  • 8FD · 3-[(2-amino-4-methylquinolin-7-yl)methoxy]-5-[(2S)-2-(methylamino)propyl]benzonitrile · ligand · 2 copies · chains A, B
  • ZN · Zinc ion · metal · chains A, B
  • ACT · Acetate ion · additive · 2 copies · chains A, B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Compared structures

  • 5UNY · Structure of rat neuronal nitric oxide synthase heme domain in complex with… · the same entry in another collection · chain A against A, TM-score 1.00

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