CodeEIG
NameMitragynine pseudoindoxyl
Synonymsmethyl (2E)-4-[(2S,2'S)-1'-butyl-4-methoxy-3-oxo-1,3-dihydrospiro[indole-2,3'-pyrrolidin]-2'-yl]-2-(methoxymethylidene)butanoate
Identifier
FormulaC23 H30 N2 O5
Molecular Weight414.495
SMILES
PubChem44301701
Formal Charge0
Total Atoms60
Total Chiral Atoms4
Total Bonds63
Total Aromatic Bonds6
Networks6
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This ligand is also present in the following 6 networks:

Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
7T2G A Peptide Opioid MOP Mus Musculus Mitragynine Pseudoindoxyl - Gi1/Beta1/Gamma2 2.5 2022-12-07 doi.org/10.1038/s41589-022-01208-y

A 2D representation of the interactions of EIG in 7T2G
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:I71 R:R:Y128 20.55 2 No No 4 5 2 2
R:R:H319 R:R:I71 15.91 2 Yes No 4 4 1 2
R:R:L121 R:R:Y75 3.52 2 Yes Yes 7 7 2 1
R:R:H319 R:R:Y75 10.89 2 Yes Yes 4 7 1 1
R:R:I322 R:R:Y75 9.67 2 Yes Yes 5 7 1 1
L:L:?1 R:R:Y75 12.45 2 Yes Yes 0 7 0 1
R:R:D147 R:R:T120 7.23 2 No No 6 6 1 2
R:R:L121 R:R:Y326 17.58 2 Yes No 7 7 2 1
R:R:N127 R:R:Q124 3.96 0 No No 6 6 2 1
L:L:?1 R:R:Q124 24.95 2 Yes No 0 6 0 1
R:R:H319 R:R:Y128 14.16 2 Yes No 4 5 1 2
R:R:D147 R:R:Y326 11.49 2 No No 6 7 1 1
L:L:?1 R:R:D147 24.59 2 Yes No 0 6 0 1
R:R:I198 R:R:Y148 3.63 0 No Yes 4 4 2 1
R:R:V202 R:R:Y148 15.14 2 No Yes 5 4 2 1
R:R:L219 R:R:Y148 3.52 2 No Yes 5 4 2 1
R:R:L232 R:R:Y148 7.03 0 No Yes 5 4 2 1
L:L:?1 R:R:Y148 12.45 2 Yes Yes 0 4 0 1
R:R:F152 R:R:M151 4.98 2 Yes Yes 7 7 2 1
R:R:M151 R:R:V236 6.09 2 Yes No 7 5 1 2
R:R:M151 R:R:W293 6.98 2 Yes Yes 7 8 1 2
L:L:?1 R:R:M151 3.53 2 Yes Yes 0 7 0 1
R:R:F152 R:R:I198 12.56 2 Yes No 7 4 2 2
R:R:F152 R:R:V236 3.93 2 Yes No 7 5 2 2
R:R:L219 R:R:V202 5.96 2 No No 5 5 2 2
R:R:K233 R:R:V300 4.55 0 Yes No 4 5 2 1
R:R:F237 R:R:H297 4.53 0 No Yes 5 8 2 1
R:R:F241 R:R:H297 18.1 0 Yes Yes 8 8 2 1
R:R:H297 R:R:W293 9.52 0 Yes Yes 8 8 1 2
R:R:I296 R:R:W318 4.7 2 Yes Yes 6 5 1 2
R:R:C321 R:R:I296 3.27 0 No Yes 6 6 2 1
R:R:I296 R:R:I322 5.89 2 Yes Yes 6 5 1 1
L:L:?1 R:R:I296 8.92 2 Yes Yes 0 6 0 1
L:L:?1 R:R:H297 4.82 2 Yes Yes 0 8 0 1
R:R:V300 R:R:W318 4.9 0 No Yes 5 5 1 2
L:L:?1 R:R:V300 3.72 2 Yes No 0 5 0 1
R:R:H319 R:R:W318 5.29 2 Yes Yes 4 5 1 2
R:R:I322 R:R:W318 10.57 2 Yes Yes 5 5 1 2
L:L:?1 R:R:H319 5.62 2 Yes Yes 0 4 0 1
L:L:?1 R:R:I322 11.6 2 Yes Yes 0 5 0 1
L:L:?1 R:R:Y326 16.85 2 Yes No 0 7 0 1
R:R:H319 R:R:T315 2.74 2 Yes No 4 4 1 2
R:R:A323 R:R:Y75 2.67 0 No Yes 4 7 2 1
R:R:S125 R:R:Y75 2.54 0 No Yes 6 7 2 1
StatisticsValue
Average Number Of Links11.00
Average Number Of Links With An Hub7.00
Average Interaction Strength11.77
Average Nodes In Shell32.00
Average Hubs In Shell14.00
Average Links In Shell44.00
Average Links Mediated by Hubs In Shell39.00

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
9ODJ A Peptide Opioid MOP Mus Musculus Mitragynine Pseudoindoxyl GTP; Mg Gi1/Beta1/Gamma2 3 2026-01-07 10.1038/s41586-025-10056-4

A 2D representation of the interactions of EIG in 9ODJ
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 R:R:Y75 8.06 21 Yes Yes 0 7 0 1
L:L:?1 R:R:Q124 8.32 21 Yes No 0 6 0 1
L:L:?1 R:R:D147 16.96 21 Yes No 0 6 0 1
L:L:?1 R:R:Y148 12.45 21 Yes No 0 4 0 1
L:L:?1 R:R:M151 3.53 21 Yes Yes 0 7 0 1
L:L:?1 R:R:I296 6.24 21 Yes No 0 6 0 1
L:L:?1 R:R:H297 4.02 21 Yes Yes 0 8 0 1
L:L:?1 R:R:I322 7.14 21 Yes No 0 5 0 1
L:L:?1 R:R:Y326 12.45 21 Yes No 0 7 0 1
R:R:S125 R:R:Y75 5.09 0 No Yes 6 7 2 1
R:R:H319 R:R:Y75 15.24 34 Yes Yes 4 7 2 1
R:R:L121 R:R:Y326 8.21 0 Yes No 7 7 2 1
R:R:N127 R:R:Q124 6.6 0 No No 6 6 2 1
R:R:D147 R:R:Y326 5.75 21 No No 6 7 1 1
R:R:V202 R:R:Y148 2.52 0 No No 5 4 2 1
R:R:F152 R:R:M151 3.73 0 No Yes 7 7 2 1
R:R:M151 R:R:W293 3.49 0 Yes Yes 7 8 1 2
R:R:K233 R:R:V300 4.55 0 No No 4 5 2 1
R:R:F237 R:R:H297 3.39 0 No Yes 5 8 2 1
R:R:F241 R:R:H297 5.66 0 No Yes 8 8 2 1
R:R:H297 R:R:W293 4.23 21 Yes Yes 8 8 1 2
R:R:H297 R:R:I296 2.65 21 Yes No 8 6 1 1
R:R:I322 R:R:W318 9.4 0 No No 5 5 1 2
R:R:L232 R:R:Y148 2.34 0 No No 5 4 2 1
L:L:?1 R:R:V300 1.86 21 Yes No 0 5 0 1
R:R:M151 R:R:V236 1.52 0 Yes No 7 5 1 2
R:R:L74 R:R:Y75 1.17 0 No Yes 5 7 2 1
StatisticsValue
Average Number Of Links10.00
Average Number Of Links With An Hub3.00
Average Interaction Strength8.10
Average Nodes In Shell25.00
Average Hubs In Shell7.00
Average Links In Shell27.00
Average Links Mediated by Hubs In Shell21.00

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
9ODL A Peptide Opioid MOP Mus Musculus Mitragynine Pseudoindoxyl GTP; Mg Gi1/Beta1/Gamma2 3.6 2026-01-07 10.1038/s41586-025-10056-4

A 2D representation of the interactions of EIG in 9ODL
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 R:R:Y75 3.66 7 Yes Yes 0 7 0 1
L:L:?1 R:R:Q124 14.97 7 Yes No 0 6 0 1
L:L:?1 R:R:D147 7.63 7 Yes No 0 6 0 1
L:L:?1 R:R:Y148 6.59 7 Yes Yes 0 4 0 1
L:L:?1 R:R:M151 10.6 7 Yes No 0 7 0 1
L:L:?1 R:R:I296 11.6 7 Yes Yes 0 6 0 1
L:L:?1 R:R:H297 4.02 7 Yes Yes 0 8 0 1
L:L:?1 R:R:V300 5.59 7 Yes No 0 5 0 1
L:L:?1 R:R:H319 4.82 7 Yes No 0 4 0 1
L:L:?1 R:R:I322 18.73 7 Yes No 0 5 0 1
R:R:I71 R:R:Y75 4.84 0 No Yes 4 7 2 1
R:R:L121 R:R:Y75 5.86 0 No Yes 7 7 2 1
R:R:S125 R:R:Y75 7.63 0 No Yes 6 7 2 1
R:R:L121 R:R:Y326 8.21 0 No Yes 7 7 2 2
R:R:Q124 R:R:Y326 3.38 0 No Yes 6 7 1 2
R:R:H319 R:R:Y128 3.27 0 No No 4 5 1 2
R:R:D147 R:R:Y326 9.2 0 No Yes 6 7 1 2
R:R:V202 R:R:Y148 11.36 7 No Yes 5 4 2 1
R:R:L219 R:R:Y148 3.52 7 Yes Yes 5 4 2 1
R:R:L232 R:R:Y148 4.69 0 No Yes 5 4 2 1
R:R:M151 R:R:W293 5.82 0 No Yes 7 8 1 2
R:R:L219 R:R:V202 4.47 7 Yes No 5 5 2 2
R:R:F237 R:R:H297 6.79 0 No Yes 5 8 2 1
R:R:F241 R:R:H297 21.5 0 No Yes 8 8 2 1
R:R:H297 R:R:I296 3.98 7 Yes Yes 8 6 1 1
R:R:C321 R:R:I296 6.55 0 No Yes 6 6 2 1
R:R:I296 R:R:I322 5.89 7 Yes No 6 5 1 1
R:R:V300 R:R:Y299 7.57 7 No No 5 4 1 2
R:R:W318 R:R:Y299 25.08 7 No No 5 4 2 2
R:R:V300 R:R:W318 2.45 7 No No 5 5 1 2
R:R:H319 R:R:T315 2.74 0 No No 4 4 1 2
R:R:L74 R:R:Y75 2.34 0 No Yes 5 7 2 1
R:R:M151 R:R:V236 1.52 0 No No 7 5 1 2
R:R:A240 R:R:H297 1.46 0 No Yes 6 8 2 1
StatisticsValue
Average Number Of Links10.00
Average Number Of Links With An Hub4.00
Average Interaction Strength8.82
Average Nodes In Shell29.00
Average Hubs In Shell8.00
Average Links In Shell34.00
Average Links Mediated by Hubs In Shell28.00

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 Links10.00
Average Number Of Links With An Hub4.17
Average Interaction Strength9.87
Average Nodes In Shell27.50
Average Hubs In Shell8.50
Average Links In Shell32.83
Average Links Mediated by Hubs In Shell26.83

missing image


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 🔍)