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Ligand · MDC

MDC · N-[2-(1-maleimidyl)ethyl]-7-diethylaminocoumarin-3-carboxamide

MDC, N-[2-(1-maleimidyl)ethyl]-7-diethylaminocoumarin-3-carboxamide (C20 H21 N3 O5, 383.4 g/mol), in the MolNFT structures on GenesisL1: bound in 3 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it…

Component
MDC
Formula
C20 H21 N3 O5
Class
ligand
Structures
3
PDB entries
2

Binding sites

MDC in 3 structures; the first of them:

  • 1A54 · Phosphate-binding protein mutant A197C labelled with a coumarin fluorophore and bound to… · MDC A323 · binds ALA13, PRO14, ALA17, TYR33, GLN34, GLY35, CYS197, TYR198 and 4 more
  • 7RY1 · human Hsp90_MC domain structure · MDC A801 · binds LEU363, MET371, ASN373, CYS374, GLU375, GLU376, LEU377, GLN405 and 2 more
  • 7RY1 · Human HSP90_MC domain structure · MDC A801 · binds LEU363, MET371, ASN373, CYS374, GLU375, GLU376, GLN405, LEU409 and 1 more

Residues it binds most

LEU 7, GLU 6, GLN 7, ASN 5, CYS 7, MET 6, ILE 4, LYS 3, ALA 1, PHE 2 (residue and the binding sites it lines).

Found with

  • 2HP · Dihydrogenphosphate ion

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