Ligand · BJB
BJB · 4-[1-(1,3-benzothiazol-6-ylsulfonyl)-5-chloro-indol-2-yl]butanoic acid
BJB, 4-[1-(1,3-benzothiazol-6-ylsulfonyl)-5-chloro-indol-2-yl]butanoic acid (C19 H15 Cl N2 O4 S2, 434.9 g/mol), in the MolNFT structures on GenesisL1: bound in 5 records (4 PDB entries). Every binding site with its residues within 4.5 Å…
- Component
- BJB
- Formula
- C19 H15 Cl N2 O4 S2
- Class
- ligand
- Structures
- 5
- PDB entries
- 4
Binding sites
BJB in 5 structures; the first of them:
- 6ENQ · Structure of human PPAR gamma LBD in complex with Lanifibranor (IVA337) · BJB A501 · binds LEU228, ILE281, GLY284, CYS285, GLN286, ARG288, SER289, ILE326 and 12 more
- 8HUK · X-ray structure of human PPAR alpha ligand binding domain-lanifibranor-SRC1 coactivator… · BJB C501 · binds GLU269, ILE272, PHE273, CYS276, GLN277, THR279, SER280, TYR314 and 12 more
- 8HUL · X-ray structure of human PPAR delta ligand binding domain-lanifibranor co-crystals… · BJB A501 · binds VAL245, PHE246, CYS249, GLN250, THR252, THR253, HIS287, ILE290 and 13 more
- 8HUM · X-ray structure of human PPAR gamma ligand binding domain-lanifibranor-SRC1 coactivator… · BJB A501 · binds ALA278, ILE281, PHE282, CYS285, GLN286, ARG288, SER289, HIS323 and 15 more
- 6ENQ · Structure of human ppar gamma lbd in complex with lanifibranor (IVA337) · BJB A501 · binds LEU228, ILE281, GLY284, CYS285, GLN286, ARG288, SER289, ILE326 and 11 more
Residues it binds most
LEU 6, ILE 6, PHE 4, HIS 5, TYR 6, MET 6, CYS 6, GLN 6, SER 4, LYS 5 (residue and the binding sites it lines).
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