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Ligand · 5V9

5V9 · ~{N}-[(4-thiophen-3-ylphenyl)methyl]cyclohexanamine

5V9, ~{N}-[(4-thiophen-3-ylphenyl)methyl]cyclohexanamine (C17 H21 N S, 271.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most…

Component
5V9
Formula
C17 H21 N S
Class
ligand
Structures
2
PDB entries
2

Binding sites

5V9 in 2 structures; the first of them:

  • 8U1Y · E.coli DsbA in complex with N-(4-(thiophen-3-yl)benzyl)cyclohexanamine · 5V9 A201 · binds HIS32, GLN35, PHE36, VAL150, PRO151, PRO163, GLN164, ASP167 and 8 more
  • 8U59 · EcDsbA soaked with N-(2-fluorophenyl)-5-methylisoxazole-3-carboxamide and… · 5V9 A201 · binds HIS32, PHE36, LEU40, VAL150, PRO151, PRO163, GLN164, THR168 and 7 more

Residues it binds most

PHE 2, PRO 2, GLN 2, GLY 2, LEU 2, MET 2, ASN 2, HIS 2, THR 2, VAL 2 (residue and the binding sites it lines).

Found with

  • CU · Copper (II) ion
  • SW0 · N-(2-fluorophenyl)-5-methyl-1,2-oxazole-3-carboxamide

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