Ligand name: N-[4-([(2-Amino-4-oxo-1,4-dihydropyrido[3,2-d]pyrimidin-6-yl)methyl]{(2E)-3-[4-carbamoyl-1-(5-O-phosphono-beta-D-ribofuranosyl)-1H-imidazol-5-yl]-2-propenoyl}amino)benzoyl]-L-glutamic acid
PDB ligand accession: MS1
DrugBank: DB04057
InChI Key: XRZABKCMPVBQFX-UGTLBTQMSA-N
SMILES: c1cc(ccc1C(=O)NC(CCC(=O)O)C(=O)O)N(Cc2ccc3c(n2)C(=O)NC(=N3)N)C(=O)C=Cc4c(ncn4C5C(C(C(O5)COP(=O)(O)O)O)O)C(=O)N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Nucleosides, nucleotides, and analogues
    • Class: Imidazole ribonucleosides and ribonucleotides
      • Subclass: 1-ribosyl-imidazolecarboxamides

List of PDB structures and/or AlphaFold models with target protein P31939

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name
P31939	Download	Predicted	P31939_F1_nD1 P31939_F1_nD2	Methylglyoxal synthase-like Cytidine deaminase-like
1P4R		Predicted	e1p4rA4 e1p4rB4 e1p4rA3 e1p4rB3 e1p4rB1 e1p4rA1
1PKX		Predicted	e1pkxA4 e1pkxC4 e1pkxB4 e1pkxD4 e1pkxA3 e1pkxC3 e1pkxB3 e1pkxD3 e1pkxA1 e1pkxD1 e1pkxC1 e1pkxB1
1PL0		Predicted	e1pl0C4 e1pl0B4 e1pl0D4 e1pl0A4 e1pl0C3 e1pl0B3 e1pl0D3 e1pl0A3 e1pl0A1 e1pl0D1 e1pl0C1 e1pl0B1
5UY8		Predicted	e5uy8A1 e5uy8B3 e5uy8C3 e5uy8D3 e5uy8A3 e5uy8B1 e5uy8C2 e5uy8D2 e5uy8A2 e5uy8B2 e5uy8C1 e5uy8D1
5UZ0		Predicted	e5uz0A3 e5uz0B3 e5uz0C3 e5uz0D3 e5uz0A2 e5uz0B1 e5uz0C1 e5uz0D2 e5uz0A1 e5uz0B2 e5uz0C2 e5uz0D1