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Ligand · KUH

KUH · ~{N}-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-3-methyl-4-oxidanylidene-5,6,7,8-tetrahydro-2~{H}-cyclohepta[c]pyrrole-1-carboxamide

KUH, ~{N}-[5-(diethylsulfamoyl)-2-methoxy-phenyl]-3-methyl-4-oxidanylidene-5,6,7,8-tetrahydro-2~{H}-cyclohepta[c]pyrrole-1-carboxamide (C22 H29 N3 O5 S, 447.6 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry).…

Component
KUH
Formula
C22 H29 N3 O5 S
Class
ligand
Structures
1
PDB entries
1

Binding sites

KUH in 1 structure; the first of them:

  • 6S4B · Crystal structure of BRD4(1) bound to inhibitor BUX1 (8) · KUH A302 · binds TRP81, PRO82, PHE83, GLN85, VAL87, LEU92, LEU94, TYR97 and 3 more

Residues it binds most

LEU 1, TYR 1, ASN 1, GLN 1, ILE 1, PHE 1, PRO 1, TRP 1, VAL 1 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion
  • BU3 · (R,R)-2,3-butanediol

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