GL1X · GenesisL1 explorer

Ligand · 7LN

7LN · N,N''-{[(2S)-3-aminopropane-1,2-diyl]bis(oxymethanediylbenzene-3,1-diyl)}dithiophene-2-carboximidamide

7LN, N,N''-{[(2S)-3-aminopropane-1,2-diyl]bis(oxymethanediylbenzene-3,1-diyl)}dithiophene-2-carboximidamide (C27 H29 N5 O2 S2, 519.7 g/mol), in the MolNFT structures on GenesisL1: bound in 6 records (3 PDB entries). Every binding site with…

Component
7LN
Formula
C27 H29 N5 O2 S2
Class
ligand
Structures
6
PDB entries
3

Binding sites

7LN in 6 structures; the first of them:

  • 4UGQ · Structure of Bacillus subtilis Nitric Oxide Synthase in complex with… · 7LN A904 · binds HIS128, GLN129, PRO216, ILE218, PHE235, ASN236, GLY237, TRP238 and 8 more
  • 4UPN · Structure of rat neuronal nitric oxide synthase heme domain in complex with… · 7LN A800 · binds MET336, LEU337, GLN478, PRO565, ALA566, VAL567, PHE584, SER585 and 9 more
  • 4UPR · Structure of bovine endothelial nitric oxide synthase heme domain in complex with… · 7LN A800 · binds VAL106, LEU107, GLN249, PRO336, ALA337, VAL338, ASN340, PHE355 and 12 more
  • 4UGQ · Structure of bacillus subtilis nitric oxide synthase in complex with… · 7LN A904 · binds HIS128, GLN129, PRO216, ILE218, PHE235, ASN236, GLY237, TRP238 and 8 more
  • 4UPN · Structure of rat neuronal nitric oxide synthase heme domain in complex with… · 7LN A800 · binds MET336, LEU337, GLN478, PRO565, ALA566, VAL567, PHE584, SER585 and 9 more
  • 4UPR · Structure of bovine endothelial nitric oxide synthase heme domain in complex with… · 7LN A800 · binds VAL106, LEU107, GLN249, PRO336, ALA337, VAL338, ASN340, PHE355 and 12 more

Residues it binds most

TRP 10, TYR 10, GLN 10, PRO 10, VAL 8, GLU 10, GLY 10, MET 10, PHE 10, ALA 8 (residue and the binding sites it lines).

Found with

  • H4B · 5,6,7,8-tetrahydrobiopterin
  • HEM · Protoporphyrin IX containing Fe
  • ZN · Zinc ion
  • ACT · Acetate ion
  • GOL · Glycerol
  • CL · Chloride ion

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