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Ligand · YQG

YQG · N-{4-[(4s,10ap)-8-chloro-2-methyl-5-oxo-5,6-dihydro[1, 2,4]triazolo[1,5-c]quinazolin-9-yl]-3-methylphenyl}-1H-imidazole-2-sulfonamide

YQG, N-{4-[(4s,10ap)-8-chloro-2-methyl-5-oxo-5,6-dihydro[1, 2,4]triazolo[1,5-c]quinazolin-9-yl]-3-methylphenyl}-1H-imidazole-2-sulfonamide (C20 H16 Cl N7 O3 S, 469.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB…

Component
YQG
Formula
C20 H16 Cl N7 O3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

YQG in 2 structures; the first of them:

  • 7M41 · Structure of TIM-3 in complex with N-(4-(8-chloro-2-methyl-5-oxo-5,6-dihydro-[1,2,4]traizo… · YQG A201 · binds LEU47, ASP53, VAL54, TRP57, THR58, SER59, ARG60, TYR61 and 6 more
  • 7M41 · Structure of tim-3 in complex with N-(4-(8-chloro-2-methyl-5-oxo-5,6… · YQG A201 · binds LEU47, ASP53, VAL54, TRP57, THR58, SER59, ARG60, TYR61 and 4 more

Residues it binds most

ARG 4, LEU 4, TRP 4, ASP 4, PHE 4, SER 4, THR 4, TYR 4, VAL 4, ASN 2 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion

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