CodeJGX
NameTamsulosin
Synonyms(R)-(−)-tamsulosin
Identifier5-[(2~{R})-2-[2-(2-ethoxyphenoxy)ethylamino]propyl]-2-methoxy-benzenesulfonamide
FormulaC20 H28 N2 O5 S
Molecular Weight408.512
SMILESCCOc1ccccc1OCCN[C@H](C)Cc2ccc(c(c2)S(=O)(=O)N)OC
PubChem129211
Formal Charge0
Total Atoms56
Total Chiral Atoms1
Total Bonds57
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
7YMJ A Amine Adrenergic Alpha1A Homo sapiens Tamsulosin - - 3.35 2023-07-05  10.1038/s41467-023-39310-x

A 2D representation of the interactions of JGX in 7YMJ
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:V79 R:R:W102 2.45 0 No Yes 8 5 2 1
R:R:D106 R:R:V79 2.92 1 No No 7 8 1 2
R:R:L80 R:R:S83 3 1 Yes No 8 7 2 1
R:R:L80 R:R:W313 2.28 1 Yes No 8 6 2 2
R:R:L80 R:R:Y316 11.72 1 Yes Yes 8 7 2 1
L:L:?1 R:R:S83 2.79 1 Yes No 0 7 0 1
L:L:?1 R:R:F86 10.17 1 Yes No 0 4 0 1
R:R:E87 R:R:K309 9.45 0 No No 5 5 1 2
L:L:?1 R:R:E87 3.69 1 Yes No 0 5 0 1
R:R:W102 R:R:W92 6.56 1 Yes Yes 5 8 1 2
R:R:C176 R:R:W92 5.22 1 No Yes 9 8 2 2
R:R:C176 R:R:W102 2.61 1 No Yes 9 5 2 1
L:L:?1 R:R:W102 7.39 1 Yes Yes 0 5 0 1
R:R:D106 R:R:Y316 5.75 1 No Yes 7 7 1 1
L:L:?1 R:R:D106 8.81 1 Yes No 0 7 0 1
R:R:S158 R:R:V107 4.85 0 No No 8 6 2 1
L:L:?1 R:R:V107 4.14 1 Yes No 0 6 0 1
L:L:?1 R:R:C110 5.89 1 Yes No 0 6 0 1
R:R:S192 R:R:T111 6.4 0 No Yes 6 7 1 2
R:R:M292 R:R:V185 3.04 1 Yes No 7 6 1 2
L:L:?1 R:R:S188 4.18 1 Yes No 0 7 0 1
R:R:A189 R:R:F289 2.77 0 No Yes 7 7 2 1
L:L:?1 R:R:S192 2.79 1 Yes No 0 6 0 1
R:R:F193 R:R:F289 13.93 0 Yes Yes 8 7 2 1
R:R:F288 R:R:W285 6.01 1 Yes Yes 7 8 1 2
R:R:F289 R:R:W285 3.01 1 Yes Yes 7 8 1 2
R:R:F288 R:R:F289 3.22 1 Yes Yes 7 7 1 1
R:R:F288 R:R:M292 3.73 1 Yes Yes 7 7 1 1
R:R:F288 R:R:V311 2.62 1 Yes No 7 5 1 2
L:L:?1 R:R:F288 9.04 1 Yes Yes 0 7 0 1
R:R:F289 R:R:M292 2.49 1 Yes Yes 7 7 1 1
L:L:?1 R:R:F289 4.52 1 Yes Yes 0 7 0 1
R:R:M292 R:R:P293 3.35 1 Yes No 7 6 1 2
L:L:?1 R:R:M292 5.24 1 Yes Yes 0 7 0 1
R:R:F308 R:R:F312 5.36 0 No No 4 6 2 1
R:R:F312 R:R:K309 2.48 0 No No 6 5 1 2
L:L:?1 R:R:F312 15.81 1 Yes No 0 6 0 1
R:R:W313 R:R:Y316 7.72 1 No Yes 6 7 2 1
L:L:?1 R:R:Y316 4.35 1 Yes Yes 0 7 0 1
StatisticsValue
Average Number Of Links14.00
Average Number Of Links With An Hub5.00
Average Interaction Strength6.34
Average Nodes In Shell30.00
Average Hubs In Shell11.00
Average Links In Shell39.00
Average Links Mediated by Hubs In Shell34.00
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 Links14.00
Average Number Of Links With An Hub5.00
Average Interaction Strength6.34
Average Nodes In Shell30.00
Average Hubs In Shell11.00
Average Links In Shell39.00
Average Links Mediated by Hubs In Shell34.00

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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 🔍)