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Ligand · YSM

YSM · 5-(3-{3-chloro-5-[(3-fluorophenyl)methoxy]phenyl}-2-oxo-2H-[1,3'-bipyridin]-5-yl)pyrimidine-2,4(1H,3H)-dione

YSM, 5-(3-{3-chloro-5-[(3-fluorophenyl)methoxy]phenyl}-2-oxo-2H-[1,3'-bipyridin]-5-yl)pyrimidine-2,4(1H,3H)-dione (C27 H18 Cl F N4 O4, 516.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding…

Component
YSM
Formula
C27 H18 Cl F N4 O4
Class
ligand
Structures
2
PDB entries
1

Binding sites

YSM in 2 structures; the first of them:

  • 7M8O · Crystal structure of the SARS-cov-2(2019-ncov) main protease in complex with compound 19 · YSM A401 · binds THR25, THR26, HIS41, TYR54, PHE140, LEU141, ASN142, GLY143 and 16 more
  • 7M8O · Crystal structure of the SARS-cov-2(2019-ncov) main protease in complex with compound 19 · YSM A401 · binds THR25, THR26, HIS41, PHE140, LEU141, ASN142, GLY143, SER144 and 12 more

Residues it binds most

HIS 2, THR 2, GLN 2, LEU 2, SER 2, ALA 2, ARG 2, ASN 2, ASP 2, CYS 2 (residue and the binding sites it lines).

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