GL1X · GenesisL1 explorer

Ligand · HBW

HBW · (2~{S})-1-[2,4-bis(chloranyl)-3-[[4-imidazol-1-yl-2-(trifluoromethyl)quinolin-8-yl]oxymethyl]phenyl]sulfonyl-~{N}-methyl-pyrrolidine-2-carboxamide

HBW, (2~{S})-1-[2,4-bis(chloranyl)-3-[[4-imidazol-1-yl-2-(trifluoromethyl)quinolin-8-yl]oxymethyl]phenyl]sulfonyl-~{N}-methyl-pyrrolidine-2-carboxamide (C26 H22 Cl2 F3 N5 O4 S, 628.5 g/mol), in the MolNFT structures on GenesisL1: bound in…

Component
HBW
Formula
C26 H22 Cl2 F3 N5 O4 S
Class
ligand
Structures
1
PDB entries
1

Binding sites

HBW in 1 structure; the first of them:

  • 6Q2W · Crystal structure of human ror gamma lbd in complex with a quinoline sulfonamide inverse… · HBW A1001 · binds GLN286, LEU287, CYS320, HIS323, LEU324, ALA327, MET358, VAL361 and 16 more

Residues it binds most

LEU 2, PHE 2, VAL 2, CYS 2, GLN 2, HIS 2, MET 2, ALA 2, ILE 2, SER 1 (residue and the binding sites it lines).

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