GL1X · GenesisL1 explorer

Ligand · 113

113 · 7,8-dihydroxy-1-methoxy-3-methyl-10-oxo-4,10-dihydro-1H,3H-pyrano[4,3-b]chromene-9-carboxylic acid

113, 7,8-dihydroxy-1-methoxy-3-methyl-10-oxo-4,10-dihydro-1H,3H-pyrano[4,3-b]chromene-9-carboxylic acid (C15 H14 O8, 322.3 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its…

Component
113
Formula
C15 H14 O8
Class
ligand
Structures
4
PDB entries
2

Binding sites

113 in 4 structures; the first of them:

  • 1HLK · Metallo-beta-lactamase from bacteroides fragilis in complex with a tricyclic inhibitor · 113 A2002 · binds ILE46, TRP49, VAL52, HIS162, CYS181, LYS184, SER190, GLY192 and 2 more
  • 1KR3 · Crystal Structure of the Metallo beta-Lactamase from Bacteroides fragilis (CfiA) in… · 113 A602 · binds ILE46, TRP49, VAL52, HIS162, CYS181, LYS184, SER190, GLY192 and 2 more
  • 1HLK · Metallo-beta-lactamase from bacteroides fragilis in complex with a tricyclic inhibitor · 113 A2002 · binds ILE46, TRP49, VAL52, HIS162, CYS181, LYS184, SER190, GLY192 and 2 more
  • 1KR3 · Crystal structure of the metallo beta-lactamase from bacteroides fragilis (cfia) in… · 113 A602 · binds ILE46, TRP49, VAL52, HIS162, CYS181, LYS184, SER190, GLY192 and 2 more

Residues it binds most

HIS 8, ILE 8, ASN 8, CYS 8, GLY 8, LYS 8, SER 8, TRP 8, VAL 8, ALA 4 (residue and the binding sites it lines).

Found with

  • NA · Sodium ion
  • ZN · Zinc ion

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