CodeALN
Name1-Naphthyl-L-alanine
Synonyms
  • (S)-2-Amino-3-(naphthalen-1-yl)propanoic acid
  • 1-Naphthyl-L-alanine
  • L-beta-(1-Naphthyl)alanine
  • Naphthalen-2-yl-3-alanine
Identifier(2S)-2-amino-3-naphthalen-1-yl-propanoic acid
FormulaC13 H13 N O2
Molecular Weight215.248
SMILESc1ccc2c(c1)cccc2C[C@@H](C(=O)O)N
PubChem6950503
Formal Charge0
Total Atoms29
Total Chiral Atoms1
Total Bonds30
Total Aromatic Bonds11
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
3OE0 A Protein Chemokine CXCR4 Homo sapiens - CVX15 - 2.9 2010-10-27 10.1126/science.1194396

A 2D representation of the interactions of ALN in 3OE0
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:D171 R:R:H113 3.78 1 Yes Yes 4 6 2 2
R:R:H113 R:R:R188 4.51 1 Yes Yes 6 5 2 1
R:R:H113 W:W:R2 7.9 1 Yes Yes 6 0 2 1
R:R:Y116 W:W:R2 15.43 1 Yes Yes 6 0 2 1
R:R:D171 R:R:T117 11.56 1 Yes Yes 4 5 2 2
R:R:T117 W:W:R2 6.47 1 Yes Yes 5 0 2 1
R:R:D171 R:R:R188 8.34 1 Yes Yes 4 5 2 1
R:R:D171 W:W:R2 5.96 1 Yes Yes 4 0 2 1
R:R:F174 R:R:Y190 12.38 1 Yes Yes 4 4 2 1
R:R:D187 W:W:C4 4.67 0 No Yes 3 0 2 1
R:R:R188 R:R:Y190 16.46 1 Yes Yes 5 4 1 1
R:R:R188 W:W:R2 26.66 1 Yes Yes 5 0 1 1
R:R:R188 W:W:?3 6.66 1 Yes Yes 5 0 1 0
R:R:V196 R:R:Y190 3.79 0 No Yes 4 4 2 1
R:R:Y190 W:W:?3 6.43 1 Yes Yes 4 0 1 0
R:R:V196 W:W:Y5 3.79 0 No No 4 0 2 2
R:R:D262 R:R:Q200 3.92 1 Yes No 5 5 2 1
R:R:Q200 W:W:?3 17.34 1 No Yes 5 0 1 0
R:R:Q200 W:W:R14 4.67 1 No Yes 5 0 1 1
R:R:D262 W:W:R14 11.91 1 Yes Yes 5 0 2 1
R:R:L266 W:W:R14 17.01 0 No Yes 3 0 2 1
R:R:E277 W:W:R14 4.65 0 Yes Yes 2 0 2 1
W:W:?3 W:W:R2 4.16 1 Yes Yes 0 0 0 1
W:W:?3 W:W:C4 4.35 1 Yes Yes 0 0 0 1
W:W:?3 W:W:R14 5 1 Yes Yes 0 0 0 1
W:W:?12 W:W:C4 3.53 1 Yes Yes 0 0 2 1
W:W:C13 W:W:C4 7.28 1 No Yes 0 0 2 1
W:W:?12 W:W:Y5 19.98 1 Yes No 0 0 2 2
W:W:R14 W:W:Y5 6.17 1 Yes No 0 0 1 2
W:W:?12 W:W:C13 4.7 1 Yes No 0 0 2 2
StatisticsValue
Average Number Of Links6.00
Average Number Of Links With An Hub5.00
Average Interaction Strength7.32
Average Nodes In Shell20.00
Average Hubs In Shell14.00
Average Links In Shell30.00
Average Links Mediated by Hubs In Shell29.00
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 Strength7.32
Average Nodes In Shell20.00
Average Hubs In Shell14.00
Average Links In Shell30.00
Average Links Mediated by Hubs In Shell29.00

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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 🔍)