2-phospho-D-glycerate

Synonyms :

• 2PG
• 2-phosphoglycerate
• 2-phosphoglyceric acid

Config Rule :

% '2-phospho-D-glycerate'


config('2-phospho-D-glycerate',[
        top(carboxyl),
        center(car(2,hyd&&phosphate)),
        bottom(hydroxymethyl)]).

Smiles String :

[C@2H]([O][P@2](=[O])([O-])[O-])([C@2H2][OH])[C](=[O])[O-]

Fischer Diagram :

Terminal :

% '2-phospho-D-glycerate'

c(1,12,(0,nonchiral))-[o(6,nil)?,o(7,nil)?,c(2,down)~],
c(2,12,(0,chiral))-[h(1,left)~,o(1,right)~,c(1,up)~,c(3,down)~],
c(3,12,(0,nonchiral))-[h(2,left)~,h(3,right)~,c(2,up)~,o(2,down)~],
h(1,1,(0,nonchiral))-[c(2,right)~],
h(2,1,(0,nonchiral))-[c(3,right)~],
h(3,1,(0,nonchiral))-[c(3,left)~],
h(4,1,(0,nonchiral))-[o(2,nil)~],
o(1,16,(0,nonchiral))-[c(2,left)~,p(1,right)~],
o(2,16,(0,nonchiral))-[h(4,nil)~,c(3,up)~],
o(3,16,(-6.666666666666666E-01,nonchiral))-[p(1,left)?],
o(4,16,(-6.666666666666666E-01,nonchiral))-[p(1,up)?],
o(5,16,(-6.666666666666666E-01,nonchiral))-[p(1,down)?],
o(6,16,(-5.0E-01,nonchiral))-[c(1,nil)?],
o(7,16,(-5.0E-01,nonchiral))-[c(1,nil)?],
p(1,31,(0,nonchiral))-[o(1,left)~,o(3,right)?,o(5,up)?,o(4,down)?]

The Terminals for all the Config Rules are in Prolog Definite Clause Grammar (DCG) form.They can be checked in the Manual here.

The compound's PDB file can be seen here.

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