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Ligand · HYM

HYM · (4Z)-4-(2-amino-5-oxo-3,5-dihydro-4H-imidazol-4-ylidene)-2,3-dichloro-4,5,6,7-tetrahydropyrrolo[2,3-c]azepin-8(1H)-one

HYM, (4Z)-4-(2-amino-5-oxo-3,5-dihydro-4H-imidazol-4-ylidene)-2,3-dichloro-4,5,6,7-tetrahydropyrrolo[2,3-c]azepin-8(1H)-one (C11 H9 Cl2 N5 O2, 314.1 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
HYM
Formula
C11 H9 Cl2 N5 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

HYM in 2 structures; the first of them:

  • 1ZLT · Crystal Structure of Chk1 Complexed with a Hymenaldisine Analog · HYM A400 · binds LEU15, GLY16, GLU17, GLY18, VAL23, ALA36, LYS38, VAL68 and 9 more
  • 1ZLT · Crystal structure of CHK1 complexed with a hymenaldisine analog · HYM A400 · binds LEU15, GLY16, GLU17, GLY18, VAL23, ALA36, LYS38, VAL68 and 9 more

Residues it binds most

GLU 2, LEU 2, GLY 2, VAL 2, ALA 2, ASN 2, ASP 2, CYS 2, LYS 2, SER 2 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion

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