CodeWYB
NameLodoxamide
SynonymsLodoxamide
Identifier
FormulaC11 H6 Cl N3 O6
Molecular Weight311.635
SMILES
PubChem44564
Formal Charge0
Total Atoms27
Total Chiral Atoms0
Total Bonds27
Total Aromatic Bonds6
Networks2
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This ligand is also present in the following 2 networks:
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
8H8J A Orphan Orphan GPR35 Homo Sapiens Lodoxamide Ca chim(NtGi1L-G13)/Beta1/Gamma2 3.2 2023-02-08 doi.org/10.1038/s41421-022-00499-8

A 2D representation of the interactions of WYB in 8H8J
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
I:I:?1 R:R:R164 4.47 2 No Yes 0 5 2 1
I:I:?1 R:R:R255 15.63 2 No Yes 0 4 2 1
L:L:?1 R:R:L80 15.19 2 Yes No 0 5 0 1
L:L:?1 R:R:F163 41.88 2 Yes Yes 0 4 0 1
L:L:?1 R:R:R164 8 2 Yes Yes 0 5 0 1
L:L:?1 R:R:L237 5.06 2 Yes Yes 0 6 0 1
L:L:?1 R:R:R240 3.55 2 Yes Yes 0 5 0 1
L:L:?1 R:R:R255 15.11 2 Yes Yes 0 4 0 1
L:L:?1 R:R:L258 4.05 2 Yes No 0 5 0 1
L:L:?1 R:R:Y259 9.43 2 Yes Yes 0 4 0 1
L:L:?1 R:R:S262 7.69 2 Yes No 0 6 0 1
R:R:L13 R:R:R255 20.65 0 No Yes 2 4 2 1
R:R:W15 R:R:Y259 8.68 0 Yes Yes 2 4 2 1
R:R:F23 R:R:Y259 6.19 0 No Yes 4 4 2 1
R:R:F163 R:R:L80 3.65 2 Yes No 4 5 1 1
R:R:R164 R:R:T83 12.94 2 Yes No 5 3 1 2
R:R:F163 R:R:Q93 29.28 2 Yes Yes 4 6 1 2
R:R:F163 R:R:Y96 4.13 2 Yes Yes 4 6 1 2
R:R:D266 R:R:Y96 12.64 2 Yes Yes 7 6 2 2
R:R:F163 R:R:L97 4.87 2 Yes Yes 4 5 1 2
R:R:R164 R:R:R255 5.33 2 Yes Yes 5 4 1 1
R:R:H168 R:R:M173 3.94 2 No Yes 3 4 2 2
R:R:H168 R:R:R240 9.03 2 No Yes 3 5 2 1
R:R:L237 R:R:M173 5.65 2 Yes Yes 6 4 1 2
R:R:M173 R:R:R240 4.96 2 Yes Yes 4 5 2 1
R:R:H234 R:R:L237 6.43 0 Yes Yes 9 6 2 1
R:R:L237 R:R:R240 3.64 2 Yes Yes 6 5 1 1
R:R:L258 R:R:R240 4.86 2 No Yes 5 5 1 1
R:R:K263 R:R:Y259 9.55 0 Yes Yes 4 4 2 1
R:R:K263 R:R:S262 4.59 0 Yes No 4 6 2 1
R:R:D266 R:R:S262 4.42 2 Yes No 7 6 2 1
R:R:I254 R:R:R240 2.51 0 No Yes 4 5 2 1
R:R:G236 R:R:L258 1.71 0 No No 5 5 2 1
R:R:K20 R:R:Y259 1.19 0 No Yes 2 4 2 1
StatisticsValue
Average Number Of Links9.00
Average Number Of Links With An Hub6.00
Average Interaction Strength12.22
Average Nodes In Shell26.00
Average Hubs In Shell15.00
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 Strength12.22
Average Nodes In Shell26.00
Average Hubs In Shell15.00
Average Links In Shell34.50
Average Links Mediated by Hubs In Shell33.50

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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 🔍)