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Ligand · 5VC

5VC · 4-(3-chloranyl-2-fluoranyl-phenoxy)-1-[[6-(1,3-thiazol-2-ylamino)pyridin-2-yl]methyl]cyclohexane-1-carboxylic acid

5VC, 4-(3-chloranyl-2-fluoranyl-phenoxy)-1-[[6-(1,3-thiazol-2-ylamino)pyridin-2-yl]methyl]cyclohexane-1-carboxylic acid (C22 H21 Cl F N3 O3 S, 461.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
5VC
Formula
C22 H21 Cl F N3 O3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

5VC in 2 structures; the first of them:

  • 5EW9 · Crystal Structure of Aurora A Kinase Domain Bound to MK-5108 · 5VC A1000 · binds LEU139, GLY140, LYS141, GLY142, VAL147, ALA160, LYS162, LEU194 and 14 more
  • 5EW9 · Crystal structure of aurora a kinase domain bound to mk-5108 · 5VC A1000 · binds LEU139, GLY140, LYS141, GLY142, VAL147, ALA160, LYS162, LEU194 and 14 more

Residues it binds most

LEU 2, ALA 2, GLY 2, GLU 2, LYS 2, ARG 2, ASN 2, PHE 2, PRO 2, THR 2 (residue and the binding sites it lines).

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