Ligand · MLQ
MLQ · (2~{R})-2-[[6-[(2,4-dichlorophenyl)sulfonylamino]-1,3-benzothiazol-2-yl]sulfanyl]octanoic acid
MLQ, (2~{R})-2-[[6-[(2,4-dichlorophenyl)sulfonylamino]-1,3-benzothiazol-2-yl]sulfanyl]octanoic acid (C21 H22 Cl2 N2 O4 S3, 533.5 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its…
- Component
- MLQ
- Formula
- C21 H22 Cl2 N2 O4 S3
- Class
- ligand
- Structures
- 4
- PDB entries
- 2
Binding sites
MLQ in 4 structures; the first of them:
- 6T6B · Crystal structure of PPARgamma in complex with compound 16 (MF27) · MLQ A501 · binds ALA278, ILE281, PHE282, GLY284, CYS285, GLN286, ARG288, SER289 and 14 more
- 6Y3U · Crystal structure of PPARgamma in complex with compound (R)-16 · MLQ A501 · binds PHE282, CYS285, ARG288, SER289, TYR327, LEU330, ILE341, SER342 and 4 more
- 6T6B · Crystal structure of ppargamma in complex with compound 16 (MF27) · MLQ A501 · binds PHE282, GLY284, CYS285, GLN286, ARG288, SER289, TYR327, ILE341 and 5 more
- 6Y3U · Crystal structure of ppargamma in complex with compound (R)-16 · MLQ A501 · binds PHE282, CYS285, ARG288, SER289, TYR327, LEU330, ILE341, SER342 and 4 more
Residues it binds most
PHE 4, SER 4, ILE 4, LEU 3, MET 4, ARG 4, CYS 4, HIS 4, LYS 4, TYR 4 (residue and the binding sites it lines).
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