GL1X · GenesisL1 explorer

Ligand · C3K

C3K · (3~{S},6~{S},7~{R},9~{a}~{S})-6-[[(2~{S})-2-(methylamino)propanoyl]amino]-5-oxidanylidene-~{N}-(phenylmethyl)-7-[(propanoylamino)methyl]-3,6,7,8,9,9~{a}-hexahydropyrrolo[1,2-a]azepine-3-carboxamide

C3K, (3~{S},6~{S},7~{R},9~{a}~{S})-6-[[(2~{S})-2-(methylamino)propanoyl]amino]-5-oxidanylidene-~{N}-(phenylmethyl)-7-[(propanoylamino)methyl]-3,6,7,8,9,9~{a}-hexahydropyrrolo[1,2-a]azepine-3-carboxamide (C25 H35 N5 O4, 469.6 g/mol), in the…

Component
C3K
Formula
C25 H35 N5 O4
Class
ligand
Structures
2
PDB entries
1

Binding sites

C3K in 2 structures; the first of them:

  • 6EXW · Crystal structure of cIAP1-BIR3 in complex with a covalently bound SM · C3K A602 · binds ARG308, CYS309, ASP297, VAL298, LYS299, GLY306, LEU307, ARG308 and 7 more
  • 6EXW · Crystal structure of CIAP1-BIR3 in complex with a covalently bound sm · C3K A602 · binds ARG308, CYS309, ASP297, VAL298, LYS299, GLY306, LEU307, ARG308 and 7 more

Residues it binds most

ARG 4, ASP 4, CYS 4, GLU 4, TRP 4, GLY 4, LEU 4, LYS 4, PHE 4, VAL 4 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion

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