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Ligand · 3OW

3OW · (2S,4S)-4-hydroxy-2-(1-methylethyl)-4-[(4S,13S)-18-[methyl(methylsulfonyl)amino]-2,15-dioxo-4-phenyl-11-oxa-3,14-diazatricyclo[14.3.1.1~5,9~]henicosa-1(20),5(21),6,8,16,18-hexaen-13-yl]-N-(2-methylpropyl)butanamide

3OW, (2S,4S)-4-hydroxy-2-(1-methylethyl)-4-[(4S,13S)-18-[methyl(methylsulfonyl)amino]-2,15-dioxo-4-phenyl-11-oxa-3,14-diazatricyclo[14.3.1.1~5,9~]henicosa-1(20),5(21),6,8,16,18-hexaen-13-yl]-N-(2-methylpropyl)butanamide (C37 H48 N4 O7 S…

Component
3OW
Formula
C37 H48 N4 O7 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

3OW in 2 structures; the first of them:

  • 3OWN · Potent macrocyclic renin inhibitors · 3OW B501 · binds THR15, GLN16, TYR17, VAL33, ASP35, GLY37, SER38, ARG79 and 23 more
  • 3OWN · Potent macrocyclic renin inhibitors · 3OW B501 · binds THR15, GLN16, TYR17, VAL33, ASP35, GLY37, SER38, ARG79 and 23 more

Residues it binds most

SER 2, TYR 2, ALA 2, ILE 2, THR 2, ASP 2, GLN 2, GLY 2, PHE 2, VAL 2 (residue and the binding sites it lines).

Found with

  • 3OX · (2S,4S)-4-hydroxy-2-(1-methylethyl)-4-[(4R,13S)-18-[methyl(methylsulfonyl)amino]-2,15-dioxo-4-phenyl-11-oxa-3,14-diazatricyclo[14.3.1.1~5,9~]henicosa-1(20),5(21),6,8,16,18-hexaen-13-yl]-N-(2-methylpropyl)butanamide
  • NA · Sodium ion
  • ACT · Acetate ion

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