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Ligand · RGW

RGW · ~{N}-(1-adamantylmethyl)-2-[(7~{R},9~{S})-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.0^{2,6}]trideca-2(6),4,10,12-tetraen-9-yl]ethanamide

RGW, ~{N}-(1-adamantylmethyl)-2-[(7~{R},9~{S})-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.0^{2,6}]trideca-2(6),4,10,12-tetraen-9-yl]ethanamide (C30 H36 Cl N5 O S, 550.2 g/mol), in the MolNFT structures on…

Component
RGW
Formula
C30 H36 Cl N5 O S
Class
ligand
Structures
2
PDB entries
1

Binding sites

RGW in 2 structures; the first of them:

  • 7AJN · Crystal Structure of the first bromodomain of BRD4 in complex with a BzD ligand · RGW A201 · binds TRP81, PRO82, PHE83, VAL87, LEU92, LEU94, TYR97, CYS136 and 6 more
  • 7AJN · Crystal structure of the first bromodomain of BRD4 in complex with a bzd ligand · RGW A201 · binds TRP81, PRO82, PHE83, VAL87, LEU92, LEU94, TYR97, CYS136 and 6 more

Residues it binds most

LEU 2, TYR 2, ASN 2, ASP 2, CYS 2, ILE 2, LYS 2, MET 2, PHE 2, PRO 2 (residue and the binding sites it lines).

Found with

  • EDO · 1,2-ethanediol

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