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Ligand · KYH

KYH · 1-[4-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl-(3-azanylpropyl) amino]butyl]guanidine

KYH, 1-[4-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl-(3-azanylpropyl) amino]butyl]guanidine (C18 H32 N10 O3, 436.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry).…

Component
KYH
Formula
C18 H32 N10 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

KYH in 2 structures; the first of them:

  • 6S7B · Crystal structure of CARM1 in complex with inhibitor UM249 · KYH A501 · binds PHE137, TYR149, PHE150, TYR153, GLN159, MET162, ARG168, GLY192 and 19 more
  • 6S7B · Crystal structure of CARM1 in complex with inhibitor UM249 · KYH A501 · binds TYR149, PHE150, TYR153, GLN159, MET162, ARG168, GLY192, CYS193 and 15 more

Residues it binds most

GLU 8, GLY 8, MET 8, TYR 8, SER 8, VAL 8, PHE 8, ALA 8, ARG 8, LYS 8 (residue and the binding sites it lines).

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