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Ligand · YQ7

YQ7 · (4r,10ap)-8-chloro-2-methyl-9-(3-methylpyridin-4-yl)[1, 2,4]triazolo[1,5-c]quinazolin-5(6H)-one

YQ7, (4r,10ap)-8-chloro-2-methyl-9-(3-methylpyridin-4-yl)[1, 2,4]triazolo[1,5-c]quinazolin-5(6H)-one (C16 H12 Cl N5 O, 325.8 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
YQ7
Formula
C16 H12 Cl N5 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

YQ7 in 2 structures; the first of them:

  • 7M3Y · Structure of TIM-3 in complex with 8-chloro-2-methyl-9-(3-mehtylpyridin-4-yl)-[1,2,4]triaz… · YQ7 B201 · binds LEU47, ASP53, VAL54, TRP57, THR58, SER59, ARG60, TYR61 and 5 more
  • 7M3Y · Structure of tim-3 in complex with 8-chloro-2-methyl-9-(3… · YQ7 B201 · binds LEU47, ASP53, VAL54, TRP57, THR58, SER59, ARG60, TYR61 and 3 more

Residues it binds most

LEU 2, TRP 2, ARG 2, ASP 2, PHE 2, SER 2, THR 2, TYR 2, VAL 2, ASN 1 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion

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