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Ligand · T5B

T5B · 2-cyclohexyl-12-[2-(3,4-dimethoxyphenyl)ethyl]-20,21-dihydroxy-25,26-dimethoxy-11,18,23-trioxa-4-azatetracyclo[22.3.1.113,17.04,9]nonacosa-1(27),13(29),14,16,24(28),25-hexaene-3,10-dione

T5B, 2-cyclohexyl-12-[2-(3,4-dimethoxyphenyl)ethyl]-20,21-dihydroxy-25,26-dimethoxy-11,18,23-trioxa-4-azatetracyclo[22.3.1.113,17.04,9]nonacosa-1(27),13(29),14,16,24(28),25-hexaene-3,10-dione (C43 H55 N O11, 761.9 g/mol), in the MolNFT…

Component
T5B
Formula
C43 H55 N O11
Class
ligand
Structures
2
PDB entries
1

Binding sites

T5B in 2 structures; the first of them:

  • 7B9Y · Structure of the FKBP51FK1 domain in complex with the macrocyclic SAFit analogue 64a · T5B A201 · binds TYR57, GLY59, LYS60, LEU61, LYS66, PHE67, ASP68, PHE77 and 12 more
  • 7B9Y · Structure of the FKBP51FK1 domain in complex with the macrocyclic safit analogue 64A · T5B A201 · binds TYR57, GLY59, LYS60, LEU61, LYS66, PHE67, ASP68, PHE77 and 12 more

Residues it binds most

LYS 2, PHE 2, GLY 2, ILE 2, LEU 2, TYR 2, ALA 2, ASP 2, GLN 2, SER 2 (residue and the binding sites it lines).

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