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Ligand · BN6

BN6 · (2S,8R,9S,15S)-15-cyclohexyl-9,12-bis(cyclopropylmethyl)-8-hydroxy-20-methyl-4,7,11,14,17-pentaoxo-2-phenyl-18-oxa-3,6,10,12,13,16-hexaazahenicosan-1-oic acid

BN6, (2S,8R,9S,15S)-15-cyclohexyl-9,12-bis(cyclopropylmethyl)-8-hydroxy-20-methyl-4,7,11,14,17-pentaoxo-2-phenyl-18-oxa-3,6,10,12,13,16-hexaazahenicosan-1-oic acid (C35 H52 N6 O9, 700.8 g/mol), in the MolNFT structures on GenesisL1: bound…

Component
BN6
Formula
C35 H52 N6 O9
Class
ligand
Structures
2
PDB entries
1

Binding sites

BN6 in 2 structures; the first of them:

  • 2F9V · HCV NS3 protease domain with NS4a peptide and a ketoamide inhibitor with P1 and P2… · BN6 A999 · binds THR40, GLN41, THR42, PHE43, VAL55, HIS57, ARG109, ARG123 and 13 more
  • 2F9V · HCV NS3 protease domain with NS4A peptide and a ketoamide inhibitor with P1 and P2… · BN6 A999 · binds THR40, GLN41, THR42, PHE43, VAL55, HIS57, ARG109, ARG123 and 13 more

Residues it binds most

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

Found with

  • ZN · Zinc ion

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