CodeWAG
Name(1S,2R)-2-[(2S)-2-azanyl-1-oxidanyl-1-oxidanylidene-3-(9H-xanthen-9-yl)propan-2-yl]cyclopropane-1-carboxylic acid
Synonyms
Identifier
FormulaC20 H19 N O5
Molecular Weight353.369
SMILES
PubChem6604829
Formal Charge0
Total Atoms45
Total Chiral Atoms4
Total Bonds48
Total Aromatic Bonds12
Networks1
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This ligand is also present in the following network:
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
8WGD C Aminoacid Metabotropic Glutamate mGlu4; mGlu2 Homo Sapiens WAG; WA6 - - 4.45 2024-11-27 doi.org/10.1038/s41467-024-54744-7

A 2D representation of the interactions of WAG in 8WGD
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)
Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
S:S:R271 S:S:Y144 4.12 10 Yes No 3 3 1 1
M:M:?1 S:S:Y144 7.32 10 Yes No 0 3 0 1
S:S:A170 S:S:T168 3.36 0 No Yes 5 7 2 1
S:S:P187 S:S:T168 3.5 10 Yes Yes 7 7 2 1
S:S:D188 S:S:T168 5.78 10 Yes Yes 6 7 1 1
M:M:?1 S:S:T168 4.6 10 Yes Yes 0 7 0 1
S:S:D188 S:S:R183 3.57 10 Yes No 6 9 1 2
S:S:D188 S:S:Y216 17.24 10 Yes Yes 6 7 1 1
S:S:D188 S:S:D295 3.99 10 Yes Yes 6 8 1 1
M:M:?1 S:S:D188 8.47 10 Yes Yes 0 6 0 1
S:S:S212 S:S:Y216 3.82 0 No Yes 6 7 2 1
S:S:R271 S:S:Y216 11.32 10 Yes Yes 3 7 1 1
S:S:D295 S:S:Y216 10.34 10 Yes Yes 8 7 1 1
M:M:?1 S:S:Y216 59.76 10 Yes Yes 0 7 0 1
S:S:D274 S:S:R271 4.76 0 Yes Yes 4 3 2 1
M:M:?1 S:S:R271 44.87 10 Yes Yes 0 3 0 1
S:S:D295 S:S:G296 5.03 10 Yes No 8 5 1 2
M:M:?1 S:S:D295 7.06 10 Yes Yes 0 8 0 1
S:S:V147 S:S:Y144 2.52 0 No No 4 3 2 1
StatisticsValue
Average Number Of Links6.00
Average Number Of Links With An Hub5.00
Average Interaction Strength22.01
Average Nodes In Shell14.00
Average Hubs In Shell8.00
Average Links In Shell19.00
Average Links Mediated by Hubs In Shell18.00
Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)
Location of the nodes interacting with this ligand (click to enlarge 🔍)
StatisticsValue
Average Number Of Links6.00
Average Number Of Links With An Hub5.00
Average Interaction Strength22.01
Average Nodes In Shell14.00
Average Hubs In Shell8.00
Average Links In Shell19.00
Average Links Mediated by Hubs In Shell18.00

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Physico-chemical properties of the nodes interacting with this ligand

(Click to enlarge 🔍)

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Location of the nodes interacting with this ligand

(Click to enlarge 🔍)