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Ligand · J7O

J7O · 5-bromanyl-~{N}-methyl-3-nitro-2-[(4~{R},5~{S})-2-(7-oxidanylisoquinolin-4-yl)carbonyl-4-phenyl-2,7-diazaspiro[4.4]nonan-7-yl]benzamide

J7O, 5-bromanyl-~{N}-methyl-3-nitro-2-[(4~{R},5~{S})-2-(7-oxidanylisoquinolin-4-yl)carbonyl-4-phenyl-2,7-diazaspiro[4.4]nonan-7-yl]benzamide (C31 H28 Br N5 O5, 630.5 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB…

Component
J7O
Formula
C31 H28 Br N5 O5
Class
ligand
Structures
1
PDB entries
1

Binding sites

J7O in 1 structure; the first of them:

  • 7EN9 · Crystal structure of SARS-cov-2 3CLPRO in complex with the non- covalent inhibitor wu-02 · J7O A401 · binds HIS41, CYS44, MET49, PHE140, LEU141, ASN142, GLY143, SER144 and 9 more

Residues it binds most

CYS 1, GLN 1, HIS 1, MET 1, ARG 1, ASN 1, ASP 1, GLU 1, GLY 1, LEU 1 (residue and the binding sites it lines).

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