CodeSMF
Name4-SULFOMETHYL-L-PHENYLALANINE
Synonyms
Identifier(2S)-2-amino-3-[4-(sulfomethyl)phenyl]propanoic acid
FormulaC10 H13 N O5 S
Molecular Weight259.279
SMILESc1cc(ccc1C[C@@H](C(=O)O)N)CS(=O)(=O)O
PubChem11010698
Formal Charge0
Total Atoms30
Total Chiral Atoms1
Total Bonds30
Total Aromatic Bonds6
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
7F8X A Peptide Cholecystokinin CCKA Homo sapiens NN9056 - - 3 2021-12-29 10.1038/s41589-021-00866-8

A 2D representation of the interactions of SMF in 7F8X
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
R:R:I100 R:R:P101 5.08 0 No Yes 5 5 2 1
R:R:F107 R:R:P101 5.78 1 Yes Yes 8 5 1 1
R:R:F109 R:R:P101 4.33 1 Yes Yes 6 5 2 1
L:L:?2 R:R:P101 3.66 1 Yes Yes 0 5 0 1
L:L:?2 R:R:N102 7.15 1 Yes No 0 6 0 1
L:L:?2 R:R:K105 6.29 1 Yes No 0 4 0 1
R:R:F107 R:R:F109 5.36 1 Yes Yes 8 6 1 2
R:R:C114 R:R:F107 4.19 1 No Yes 9 8 2 1
R:R:F107 R:R:L182 3.65 1 Yes No 8 5 1 2
R:R:C196 R:R:F107 8.38 1 No Yes 9 8 2 1
L:L:?2 R:R:F107 5.43 1 Yes Yes 0 8 0 1
R:R:C114 R:R:C196 7.28 1 No No 9 9 2 2
L:L:?6 R:R:M121 4.01 1 Yes Yes 0 7 1 2
L:L:?8 R:R:M121 8.45 1 Yes Yes 0 7 2 2
R:R:M195 R:R:V183 6.09 1 Yes No 4 3 1 2
R:R:F185 R:R:M195 3.73 0 No Yes 4 4 2 1
R:R:M195 R:R:R197 16.13 1 Yes Yes 4 4 1 1
L:L:?2 R:R:M195 11.57 1 Yes Yes 0 4 0 1
L:L:?2 R:R:R197 11.75 1 Yes Yes 0 4 0 1
L:L:?3 R:R:R197 8.04 1 Yes Yes 0 4 1 1
L:L:G4 R:R:R197 4.5 1 Yes Yes 0 4 2 1
L:L:?3 R:R:E344 13.78 1 Yes Yes 0 1 1 2
L:L:G4 R:R:E344 6.55 1 Yes Yes 0 1 2 2
L:L:?3 R:R:S348 8.52 1 Yes No 0 5 1 2
L:L:?2 L:L:?3 15.57 1 Yes Yes 0 0 0 1
L:L:?2 L:L:?6 8.76 1 Yes Yes 0 0 0 1
L:L:?3 L:L:G4 4.85 1 Yes Yes 0 0 1 2
L:L:G4 L:L:W5 5.63 1 Yes Yes 0 0 2 2
L:L:?6 L:L:W5 9.69 1 Yes Yes 0 0 1 2
L:L:?6 L:L:?7 23.47 1 Yes Yes 0 0 1 2
L:L:?6 L:L:?8 11.18 1 Yes Yes 0 0 1 2
L:L:?7 L:L:?8 34.46 1 Yes Yes 0 0 2 2
R:R:F107 R:R:V113 2.62 1 Yes No 8 5 1 2
L:L:?2 L:L:D1 2.02 1 Yes No 0 0 0 1
StatisticsValue
Average Number Of Links9.00
Average Number Of Links With An Hub6.00
Average Interaction Strength8.02
Average Nodes In Shell25.00
Average Hubs In Shell14.00
Average Links In Shell34.00
Average Links Mediated by Hubs In Shell33.00
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 Links9.00
Average Number Of Links With An Hub6.00
Average Interaction Strength8.02
Average Nodes In Shell25.00
Average Hubs In Shell14.00
Average Links In Shell34.00
Average Links Mediated by Hubs In Shell33.00

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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 🔍)