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Ligand · JGL

JGL · ~{N}-[4-[2,4-bis(fluoranyl)phenoxy]-3-[2-(1~{H}-imidazol-5-yl)-5-methyl-4-oxidanylidene-furo[3,2-c]pyridin-7-yl]phenyl]ethanesulfonamide

JGL, ~{N}-[4-[2,4-bis(fluoranyl)phenoxy]-3-[2-(1~{H}-imidazol-5-yl)-5-methyl-4-oxidanylidene-furo[3,2-c]pyridin-7-yl]phenyl]ethanesulfonamide (C25 H20 F2 N4 O5 S, 526.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1…

Component
JGL
Formula
C25 H20 F2 N4 O5 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

JGL in 2 structures; the first of them:

  • 7WN5 · Crystal Structure of the second bromodomain of human BRD2 in complex with the inhibitor… · JGL A501 · binds TRP370, PRO371, PHE372, TYR373, LYS374, PRO375, VAL376, ASP377 and 8 more
  • 7WN5 · Crystal structure of the second bromodomain of human BRD2 in complex with the inhibitor… · JGL A501 · binds TRP370, PRO371, PHE372, LYS374, PRO375, VAL376, ASP377, LEU381 and 7 more

Residues it binds most

ASP 4, LEU 4, PRO 4, VAL 4, ASN 4, CYS 4, HIS 4, LYS 4, MET 4, PHE 4 (residue and the binding sites it lines).

Found with

  • K · Potassium ion
  • EDO · 1,2-ethanediol

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