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Ligand · 7HI

7HI · (3R,5R)-7-[3-(biphenyl-4-ylcarbamoyl)-2-ethyl-5,6,7,8-tetrahydrocyclohepta[b]pyrrol-1(4H)-yl]-3,5-dihydroxyheptanoic acid

7HI, (3R,5R)-7-[3-(biphenyl-4-ylcarbamoyl)-2-ethyl-5,6,7,8-tetrahydrocyclohepta[b]pyrrol-1(4H)-yl]-3,5-dihydroxyheptanoic acid (C31 H38 N2 O5, 518.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
7HI
Formula
C31 H38 N2 O5
Class
ligand
Structures
2
PDB entries
1

Binding sites

7HI in 2 structures; the first of them:

  • 3CD5 · Thermodynamic and structure guided design of statin hmg-coa reductase inhibitors · 7HI A2 · binds GLU559, CYS561, LEU562, ALA564, SER565, ARG568, LYS735, ALA751 and 19 more
  • 3CD5 · Thermodynamic and structure guided design of statin hmg-CoA reductase inhibitors · 7HI A2 · binds GLU559, CYS561, LEU562, ALA564, SER565, ARG568, LYS735, ALA751 and 19 more

Residues it binds most

LYS 8, LEU 8, ALA 8, SER 8, ARG 8, ASN 8, HIS 8, VAL 8, CYS 8, ASP 8 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion

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