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Ligand · 0N0

0N0 · (3S,5R)-N-{[9-(4-methoxybutyl)-9H-xanthen-9-yl]methyl}-5-{[(4-methylphenyl)sulfonyl]amino}piperidine-3-carboxamide

0N0, (3S,5R)-N-{[9-(4-methoxybutyl)-9H-xanthen-9-yl]methyl}-5-{[(4-methylphenyl)sulfonyl]amino}piperidine-3-carboxamide (C32 H39 N3 O5 S, 577.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding…

Component
0N0
Formula
C32 H39 N3 O5 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

0N0 in 2 structures; the first of them:

  • 4GJD · Crystal structure of renin in complex with NVP-BGQ311 (compound 12) · 0N0 A1001 · binds THR12, GLN13, TYR14, VAL30, ASP32, GLY34, SER35, ARG74 and 20 more
  • 4GJD · Crystal structure of renin in complex with nvp-BGQ311 (compound 12) · 0N0 A1001 · binds THR12, GLN13, TYR14, VAL30, ASP32, GLY34, SER35, ARG74 and 20 more

Residues it binds most

ALA 4, SER 4, TYR 4, ASP 4, THR 4, GLY 4, LEU 4, PHE 4, PRO 4, VAL 4 (residue and the binding sites it lines).

Found with

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • SO4 · Sulfate ion

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