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Ligand · KNR

KNR · 1-[(8~{R},15~{S},18~{S})-18-(4-azanylbutyl)-15-butyl-4, 7,14,17,20-pentakis(oxidanylidene)-3,6,13,16,19-pentazabicyclo[20.3.1]hexacosa-1(26),22,24-trien-8-yl]guanidine

KNR, 1-[(8~{R},15~{S},18~{S})-18-(4-azanylbutyl)-15-butyl-4, 7,14,17,20-pentakis(oxidanylidene)-3,6,13,16,19-pentazabicyclo[20.3.1]hexacosa-1(26),22,24-trien-8-yl]guanidine (C30 H49 N9 O5, 615.8 g/mol), in the MolNFT structures on…

Component
KNR
Formula
C30 H49 N9 O5
Class
ligand
Structures
2
PDB entries
1

Binding sites

KNR in 2 structures; the first of them:

  • 7ZYS · Crystal Structure of Unlinked NS2B-NS3 Protease from Zika Virus in Complex with Inhibitor… · KNR B201 · binds ASP83, PHE84, SER85, HIS51, ASP129, TYR130, PRO131, ALA132 and 10 more
  • 7ZYS · Crystal structure of unlinked NS2B-NS3 protease from zika virus in complex with inhibitor… · KNR B201 · binds ASP83, PHE84, SER85, HIS51, ASP129, TYR130, PRO131, ALA132 and 10 more

Residues it binds most

GLY 2, SER 2, TYR 2, ASP 2, VAL 2, ALA 2, ASN 2, HIS 2, PHE 2, PRO 2 (residue and the binding sites it lines).

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