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Ligand · H9M

H9M · (2S)-N-[(2S)-2-cyclohexyl-2-({N-propanoyl-3-[6-(propan-2-yl)-1,3-benzothiazol-2-yl]-L-alanyl}amino)ethyl]-4-(dimethylamino)-2-methylbutanamide

H9M, (2S)-N-[(2S)-2-cyclohexyl-2-({N-propanoyl-3-[6-(propan-2-yl)-1,3-benzothiazol-2-yl]-L-alanyl}amino)ethyl]-4-(dimethylamino)-2-methylbutanamide (C31 H49 N5 O3 S, 571.8 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records…

Component
H9M
Formula
C31 H49 N5 O3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

H9M in 2 structures; the first of them:

  • 6XON · DCN1 bound to inhibitor 9 · H9M A1301 · binds ILE1086, PHE1089, CYS1090, PRO1097, ALA1098, SER1099, VAL1102, LEU1103 and 15 more
  • 6XON · DCN1 bound to inhibitor 9 · H9M A1301 · binds ILE1086, PHE1089, CYS1090, PRO1097, ALA1098, SER1099, VAL1102, LEU1103 and 15 more

Residues it binds most

ALA 2, PHE 2, CYS 2, ILE 2, LEU 2, ASN 2, GLN 2, GLU 2, MET 2, PRO 2 (residue and the binding sites it lines).

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