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Ligand · 3T3

3T3 · [(amino-kappaN)methanethiolato](3-fluoro-9-hydroxypyrido[2,3-a]pyrrolo[3,4-c]carbazole-5,7(6H,12H)-dionato-kappa~2~N,N')(1,4,7-trithionane-kappa~3~S~1~,S~4~,S~7~)ruthenium

3T3, [(amino-kappaN)methanethiolato](3-fluoro-9-hydroxypyrido[2,3-a]pyrrolo[3,4-c]carbazole-5,7(6H,12H)-dionato-kappa~2~N,N')(1,4,7-trithionane-kappa~3~S~1~,S~4~,S~7~)ruthenium (C24 H22 F N4 O3 Ru S4, 662.8 g/mol), in the MolNFT structures…

Component
3T3
Formula
C24 H22 F N4 O3 Ru S4
Class
ligand
Structures
2
PDB entries
1

Binding sites

3T3 in 2 structures; the first of them:

  • 4RLO · Human p70s6k1 with ruthenium-based inhibitor EM5 · 3T3 A401 · binds ARG95, LEU97, GLY98, LYS99, GLY100, GLY103, LYS104, VAL105 and 14 more
  • 4RLO · Human P70S6K1 with ruthenium-based inhibitor EM5 · 3T3 A401 · binds ARG95, LEU97, GLY98, LYS99, GLY100, GLY103, LYS104, VAL105 and 14 more

Residues it binds most

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

Found with

  • STU · Staurosporine
  • CL · Chloride ion
  • SO4 · Sulfate ion
  • DMS · Dimethyl sulfoxide
  • GOL · Glycerol

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