GL1X · GenesisL1 explorer

Ligand · TGQ

TGQ · (2~{S})-2-[[4-[[(6~{R})-2-azanyl-4-oxidanylidene-5,6,7,8-tetrahydro-1~{H}-pteridin-6-yl]methyl-methyl-amino]phenyl]carbonylamino]pentanedioic acid

TGQ, (2~{S})-2-[[4-[[(6~{R})-2-azanyl-4-oxidanylidene-5,6,7,8-tetrahydro-1~{H}-pteridin-6-yl]methyl-methyl-amino]phenyl]carbonylamino]pentanedioic acid (C20 H25 N7 O6, 459.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records…

Component
TGQ
Formula
C20 H25 N7 O6
Class
ligand
Structures
2
PDB entries
1

Binding sites

TGQ in 2 structures; the first of them:

  • 6F6Z · Mouse Thymidylate Synthase Cocrystallized with N(4)OHdCMP and Soaked in… · TGQ A502 · binds PHE74, GLU81, ILE102, TRP103, ASN106, ASP212, LEU215, GLY216 and 5 more
  • 6F6Z · Mouse thymidylate synthase cocrystallized with N(4)OHDCMP and soaked in… · TGQ A502 · binds PHE74, GLU81, ILE102, TRP103, ASN106, ASP212, LEU215, GLY216 and 5 more

Residues it binds most

ASN 4, PHE 4, ILE 4, LEU 4, ALA 4, ASP 4, GLU 4, GLY 4, MET 4, TRP 4 (residue and the binding sites it lines).

Found with

  • NOH · 2'-deoxy-N-hydroxycytidine 5'-(dihydrogen phosphate)

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