CodeBNG
NameB-nonylglucoside
SynonymsBeta-NONYLGLUCOSIDE; nonyl beta-D-glucoside; nonyl D-glucoside; nonyl glucoside
Identifier(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-nonoxy-oxane-3,4,5-triol
FormulaC15 H30 O6
Molecular Weight306.395
SMILESCCCCCCCCCO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
PubChem155448
Formal Charge0
Total Atoms51
Total Chiral Atoms5
Total Bonds51
Total Aromatic Bonds0
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
4X1H A Sensory Opsins Rhodopsin Bos taurus Nonyl Beta-D-Glucopyranoside - Gt(CT) 2.29 2015-11-04 10.1016/j.str.2015.09.015

A 2D representation of the interactions of BNG in 4X1H
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:F91 R:R:K296 7.44 0 Yes No 7 7 2 1
R:R:T118 R:R:Y178 8.74 0 No Yes 4 3 1 2
L:L:?1 R:R:T118 3.99 1 Yes No 0 4 0 1
L:L:?1 R:R:G121 4.63 1 Yes No 0 7 0 1
R:R:E122 R:R:L125 3.98 1 Yes No 6 7 1 2
R:R:C167 R:R:E122 10.64 1 No Yes 5 6 2 1
R:R:E122 R:R:H211 6.15 1 Yes Yes 6 6 1 2
L:L:?1 R:R:E122 4.79 1 Yes Yes 0 6 0 1
R:R:L125 R:R:W265 13.67 0 No Yes 7 8 2 1
R:R:C167 R:R:M207 4.86 1 No Yes 5 5 2 1
R:R:C167 R:R:H211 7.37 1 No Yes 5 6 2 2
R:R:F203 R:R:I189 6.28 1 Yes No 6 4 2 1
L:L:?1 R:R:I189 7.73 1 Yes No 0 4 0 1
R:R:Y191 R:R:Y192 8.94 1 Yes Yes 6 5 1 2
R:R:Y191 R:R:Y268 6.95 1 Yes Yes 6 6 1 1
R:R:M288 R:R:Y191 5.99 1 No Yes 4 6 2 1
L:L:?1 R:R:Y191 12.7 1 Yes Yes 0 6 0 1
R:R:M288 R:R:Y192 7.18 1 No Yes 4 5 2 2
R:R:F203 R:R:M207 6.22 1 Yes Yes 6 5 2 1
R:R:H211 R:R:M207 5.25 1 Yes Yes 6 5 2 1
L:L:?1 R:R:M207 7.66 1 Yes Yes 0 5 0 1
R:R:F208 R:R:F212 5.36 1 No Yes 5 8 2 1
R:R:F208 R:R:I213 7.54 1 No No 5 4 2 2
R:R:F212 R:R:I213 3.77 1 Yes No 8 4 1 2
R:R:A269 R:R:F212 8.32 0 No Yes 7 8 2 1
L:L:?1 R:R:F212 4.4 1 Yes Yes 0 8 0 1
R:R:F261 R:R:W265 5.01 0 No Yes 9 8 2 1
R:R:C264 R:R:W265 10.45 3 No Yes 8 8 2 1
L:L:?1 R:R:W265 10.28 1 Yes Yes 0 8 0 1
R:R:P291 R:R:Y268 11.13 0 No Yes 6 6 2 1
L:L:?1 R:R:Y268 26.46 1 Yes Yes 0 6 0 1
L:L:?1 R:R:A272 5.69 1 Yes No 0 5 0 1
L:L:?1 R:R:K296 3.82 1 Yes No 0 7 0 1
R:R:F212 R:R:L216 3.65 1 Yes No 8 7 1 2
R:R:F261 R:R:L216 3.65 0 No No 9 7 2 2
R:R:A168 R:R:T118 3.36 0 No No 7 4 2 1
R:R:A292 R:R:Y268 2.67 0 No Yes 5 6 2 1
R:R:A295 R:R:Y268 2.67 0 No Yes 8 6 2 1
R:R:F212 R:R:L266 2.44 1 Yes No 8 6 1 2
R:R:G120 R:R:G121 2.11 0 No No 8 7 2 1
R:R:A272 R:R:V204 1.7 0 No No 5 4 1 2
StatisticsValue
Average Number Of Links11.00
Average Number Of Links With An Hub6.00
Average Interaction Strength8.38
Average Nodes In Shell33.00
Average Hubs In Shell12.00
Average Links In Shell41.00
Average Links Mediated by Hubs In Shell36.00
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 Links11.00
Average Number Of Links With An Hub6.00
Average Interaction Strength8.38
Average Nodes In Shell33.00
Average Hubs In Shell12.00
Average Links In Shell41.00
Average Links Mediated by Hubs In Shell36.00

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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 🔍)