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Ligand · W7E

W7E · 2-[[4-[2-[[3-[(2-methyl-1,3-benzothiazol-6-yl)amino]-3-oxidanylidene-propyl]carbamoylamino]ethoxy]phenyl]methyl]propanedioic acid

W7E, 2-[[4-[2-[[3-[(2-methyl-1,3-benzothiazol-6-yl)amino]-3-oxidanylidene-propyl]carbamoylamino]ethoxy]phenyl]methyl]propanedioic acid (C24 H26 N4 O7 S, 514.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry).…

Component
W7E
Formula
C24 H26 N4 O7 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

W7E in 2 structures; the first of them:

  • 4AL4 · rat LDHA in complex with 2-((4-(2-((3-((2-methyl-1,3-benzothiazol-6… · W7E A1333 · binds VAL25, GLY26, VAL27, GLY28, VAL30, VAL50, ASP51, VAL52 and 19 more
  • 4AL4 · Rat ldha in complex with 2-((4-(2-((3-((2-methyl-1,3-benzothiazol-6… · W7E A1333 · binds VAL25, GLY26, VAL27, GLY28, VAL30, VAL50, ASP51, VAL52 and 19 more

Residues it binds most

VAL 14, ARG 14, GLY 14, ALA 14, ILE 14, THR 8, TYR 10, ASN 8, ASP 8, GLN 8 (residue and the binding sites it lines).

Found with

  • GOL · Glycerol

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