Ligand · 21Q

21Q · 4-acetyl-N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-3-ethyl-5-methyl-1H-pyrrole-2-carboxamide

21Q, 4-acetyl-N-[5-(diethylsulfamoyl)-2-hydroxyphenyl]-3-ethyl-5-methyl-1H-pyrrole-2-carboxamide (C20 H27 N3 O5 S, 421.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component: 21Q
Formula: C20 H27 N3 O5 S
Class: ligand
Structures: 2
PDB entries: 1

Binding sites

21Q in 2 structures; the first of them:

4LYW · Crystal Structure of BRD4(1) bound to inhibitor XD14 · 21Q A1001 · binds TRP81, PRO82, PHE83, GLN85, VAL87, ASP88, LYS91, LEU92 and 6 more
4LYW · Crystal structure of BRD4(1) bound to inhibitor XD14 · 21Q A1001 · binds TRP81, PRO82, PHE83, GLN85, VAL87, ASP88, LYS91, LEU92 and 6 more

Residues it binds most

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

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