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Ligand · 7MW

7MW · methyl 4-propanoyl-1~{H}-pyrrole-2-carboxylate

7MW, methyl 4-propanoyl-1~{H}-pyrrole-2-carboxylate (C9 H11 N O3, 181.2 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 binds most and…

Component
7MW
Formula
C9 H11 N O3
Class
ligand
Structures
3
PDB entries
2

Binding sites

7MW in 3 structures; the first of them:

  • 5MGF · Crystal Structure of BAZ2B bromodomain in complex with 4-propionyl-pyrrole derivative 2 · 7MW A2001 · binds PRO1888, PHE1889, VAL1893, VAL1898, TYR1901, PHE1943, ASN1944, ILE1950
  • 5MGF · Crystal structure of BAZ2B bromodomain in complex with 4-propionyl- pyrrole derivative 2 · 7MW A2001 · binds PRO1888, PHE1889, VAL1893, VAL1898, TYR1901, PHE1943, ASN1944, ILE1950
  • 5MGK · Crystal structure of BAZ2A bromodomain in complex with 4-propionyl- pyrrole derivative 2 · 7MW A1901 · binds PRO1817, PHE1818, VAL1822, VAL1827, TYR1830, PHE1872, ASN1873, VAL1879

Residues it binds most

VAL 3, PHE 3, ASN 3, PRO 3, TYR 3, ILE 2 (residue and the binding sites it lines).

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