CodeTHO
NameL-Threoninol
SynonymsL-Threoninol
Identifier
FormulaC4 H11 N O2
Molecular Weight105.136
SMILES
PubChem2033049
Formal Charge0
Total Atoms18
Total Chiral Atoms2
Total Bonds17
Total Aromatic Bonds0
Networks4
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This ligand is also present in the following 4 networks:
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
7T11 A Peptide Somatostatin SST2 Homo Sapiens Octreotide - Gi3/Beta1/Gamma2 2.7 2022-03-09 doi.org/10.1038/s41594-022-00727-5

A 2D representation of the interactions of THO in 7T11
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
L:L:?1 L:L:C2 13.45 1 Yes No 0 0 1 2
L:L:?1 L:L:C7 4.03 1 Yes Yes 0 0 1 1
L:L:?1 L:L:?8 19.78 1 Yes Yes 0 0 1 0
L:L:?1 R:R:W188 3.86 1 Yes Yes 0 2 1 1
L:L:?1 R:R:P286 8.35 1 Yes No 0 2 1 2
L:L:C2 L:L:C7 7.28 1 No Yes 0 0 2 1
L:L:C2 R:R:F294 8.38 1 No Yes 0 4 2 2
L:L:?8 L:L:T6 1.91 1 Yes Yes 0 0 0 1
L:L:T6 R:R:Q102 11.34 1 Yes No 0 5 1 2
L:L:T6 R:R:S192 3.2 1 Yes Yes 0 4 1 1
L:L:T6 R:R:T194 3.14 1 Yes Yes 0 4 1 1
L:L:?8 L:L:C7 2.06 1 Yes Yes 0 0 0 1
L:L:C7 R:R:F294 6.98 1 Yes Yes 0 4 1 2
L:L:?8 R:R:R184 3.15 1 Yes Yes 0 2 0 1
L:L:?8 R:R:N186 10.69 1 Yes No 0 1 0 1
L:L:?8 R:R:W188 5.91 1 Yes Yes 0 2 0 1
L:L:?8 R:R:S192 3.9 1 Yes Yes 0 4 0 1
L:L:?8 R:R:T194 1.91 1 Yes Yes 0 4 0 1
R:R:Q102 R:R:S192 4.33 1 No Yes 5 4 2 1
R:R:V106 R:R:W188 2.45 0 No Yes 4 2 2 1
R:R:R190 R:R:V106 11.77 0 Yes No 1 4 2 2
R:R:R184 R:R:T194 5.17 1 Yes Yes 2 4 1 1
R:R:N196 R:R:R184 7.23 0 No Yes 3 2 2 1
R:R:E200 R:R:R184 4.65 0 No Yes 4 2 2 1
R:R:R184 R:R:Y205 2.06 1 Yes Yes 2 4 1 2
R:R:N186 R:R:W188 3.39 1 No Yes 1 2 1 1
R:R:N186 R:R:R190 3.62 1 No Yes 1 1 1 2
R:R:Q187 R:R:W188 7.67 0 No Yes 2 2 2 1
R:R:K291 R:R:W188 3.48 0 No Yes 3 2 2 1
R:R:S192 R:R:T194 6.4 1 Yes Yes 4 4 1 1
StatisticsValue
Average Number Of Links8.00
Average Number Of Links With An Hub7.00
Average Interaction Strength6.16
Average Nodes In Shell20.00
Average Hubs In Shell11.00
Average Links In Shell30.00
Average Links Mediated by Hubs In Shell30.00
Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)
Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
7YAE A Peptide Somatostatin SST2 Homo Sapiens Octreotide - Gi1/Beta1/Gamma2 3.37 2023-04-19 doi.org/10.1038/s41467-023-36673-z

A 2D representation of the interactions of THO in 7YAE
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:Q102 R:R:S192 5.78 5 Yes No 5 4 2 1
R:R:N186 R:R:S192 7.45 0 No No 1 4 2 1
R:R:I195 R:R:T194 3.04 4 Yes No 5 4 2 1
L:L:?8 R:R:T194 7.65 19 Yes No 0 4 0 1
L:L:?1 R:R:P286 5.57 19 Yes No 0 2 1 2
L:L:C7 R:R:F294 2.79 19 Yes Yes 0 4 1 2
L:L:?1 L:L:C2 10.76 19 Yes No 0 0 1 2
L:L:?1 L:L:C7 13.45 19 Yes Yes 0 0 1 1
L:L:?1 L:L:?8 16.74 19 Yes Yes 0 0 1 0
L:L:C2 L:L:C7 7.28 19 No Yes 0 0 2 1
L:L:?8 L:L:C7 4.12 19 Yes Yes 0 0 0 1
L:L:?1 R:R:I284 2.42 19 Yes No 0 1 1 2
L:L:?8 R:R:S192 1.95 19 Yes No 0 4 0 1
L:L:C7 R:R:K291 1.62 19 Yes No 0 3 1 2
StatisticsValue
Average Number Of Links4.00
Average Number Of Links With An Hub2.00
Average Interaction Strength7.62
Average Nodes In Shell13.00
Average Hubs In Shell6.00
Average Links In Shell14.00
Average Links Mediated by Hubs In Shell13.00
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 Links5.25
Average Number Of Links With An Hub3.75
Average Interaction Strength7.52
Average Nodes In Shell16.00
Average Hubs In Shell7.25
Average Links In Shell20.50
Average Links Mediated by Hubs In Shell19.25

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Physico-chemical properties of the nodes interacting with this ligand

(Click to enlarge 🔍)

missing image


Location of the nodes interacting with this ligand

(Click to enlarge 🔍)