Ligand · S36

S36 · 3,4-dihydroisoquinolin-2(1H)-yl[2,4-dihydroxy-5-(propan-2-yl)phenyl]methanone

S36, 3,4-dihydroisoquinolin-2(1H)-yl[2,4-dihydroxy-5-(propan-2-yl)phenyl]methanone (C19 H21 N O3, 311.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the…

Component: S36
Formula: C19 H21 N O3
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

S36 in 2 structures; the first of them:

4L93 · Crystal structure of Human Hsp90 with S36 · S36 A301 · binds LEU48, ASN51, SER52, ASP54, ALA55, LYS58, ASP93, ILE96 and 8 more
4L93 · Crystal structure of human HSP90 with S36 · S36 A301 · binds LEU48, ASN51, SER52, ASP54, ALA55, LYS58, ASP93, ILE96 and 8 more

Residues it binds most

ASP 4, LEU 4, VAL 4, THR 4, ALA 4, ASN 4, GLY 4, ILE 4, LYS 4, MET 4 (residue and the binding sites it lines).

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