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Ligand · 7TO

7TO · 4-({(3R)-7-cyano-4-[(4-methoxyphenyl)sulfonyl]-1-[(1-methyl-1H-imidazol-5-yl)methyl]-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl}methyl)phenyl trifluoromethanesulfonate

7TO, 4-({(3R)-7-cyano-4-[(4-methoxyphenyl)sulfonyl]-1-[(1-methyl-1H-imidazol-5-yl)methyl]-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl}methyl)phenyl trifluoromethanesulfonate (C30 H28 F3 N5 O6 S2, 675.7 g/mol), in the MolNFT structures on…

Component
7TO
Formula
C30 H28 F3 N5 O6 S2
Class
ligand
Structures
2
PDB entries
1

Binding sites

7TO in 2 structures; the first of them:

  • 4GTO · FTase in complex with BMS analogue 14 · 7TO B502 · binds CYS95, LEU96, TRP102, TRP106, TYR154, ARG202, TYR205, CYS206 and 9 more
  • 4GTO · Ftase in complex with bms analogue 14 · 7TO B502 · binds CYS95, LEU96, TRP102, TRP106, TYR154, ARG202, TYR205, CYS206 and 9 more

Residues it binds most

CYS 2, TYR 2, TRP 2, ASP 2, ARG 2, HIS 2, LEU 2, PHE 2 (residue and the binding sites it lines).

Found with

  • FPP · Farnesyl diphosphate
  • ZN · Zinc ion
  • DMS · Dimethyl sulfoxide

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