Ligand · 1E6
1E6 · 6-({2-[(5-chloro-4-{[(2S)-2,3-dihydroxypropyl]oxy}-2-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)pyridine-3-carboxylic acid
1E6, 6-({2-[(5-chloro-4-{[(2S)-2,3-dihydroxypropyl]oxy}-2-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)pyridine-3-carboxylic acid (C18 H19 Cl N2 O7 S, 442.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…
- Component
- 1E6
- Formula
- C18 H19 Cl N2 O7 S
- Class
- ligand
- Structures
- 2
- PDB entries
- 1
Binding sites
1E6 in 2 structures; the first of them:
- 4I9N · Crystal structure of rabbit LDHA in complex with AP28161 and AP28122 · 1E6 A401 · binds VAL25, GLY26, VAL27, GLY28, VAL50, ASP51, VAL52, MET53 and 9 more
- 4I9N · Crystal structure of rabbit ldha in complex with AP28161 and AP28122 · 1E6 A401 · binds VAL25, GLY26, VAL27, GLY28, VAL50, ASP51, VAL52, MET53 and 9 more
Residues it binds most
VAL 16, GLY 16, ILE 16, ARG 16, ALA 16, ASN 16, ASP 16, PHE 16, THR 16, MET 6 (residue and the binding sites it lines).
Found with
- 1E5 · 6-[3-(carboxymethoxy)-5-fluorophenyl]pyridine-3-carboxylic acid
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