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Ligand · K5K

K5K · 2-[4-[(1~{S})-1-[[4,5-bis(chloranyl)-1,6-dimethyl-indol-2-yl]carbonylamino]-2-oxidanyl-ethyl]phenyl]sulfonylethanoic acid

K5K, 2-[4-[(1~{S})-1-[[4,5-bis(chloranyl)-1,6-dimethyl-indol-2-yl]carbonylamino]-2-oxidanyl-ethyl]phenyl]sulfonylethanoic acid (C21 H20 Cl2 N2 O6 S, 499.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry).…

Component
K5K
Formula
C21 H20 Cl2 N2 O6 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

K5K in 2 structures; the first of them:

  • 6RJ6 · Crystal structure of PHGDH in complex with BI-4924 · K5K A401 · binds LEU150, GLY151, GLY153, ARG154, ILE155, TYR173, ASP174, PRO175 and 10 more
  • 6RJ6 · Crystal structure of phgdh in complex with bi-4924 · K5K A401 · binds LEU150, GLY151, GLY153, ARG154, ILE155, TYR173, ASP174, PRO175 and 10 more

Residues it binds most

ILE 4, LEU 4, GLY 4, PRO 4, THR 4, ASP 4, HIS 4, SER 4, TYR 4, ALA 2 (residue and the binding sites it lines).

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