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Receptor
PDB id Resolution Class Description Source Keywords
3DZT 1.8 Å NON-ENZYME: OTHER AED7-LEUKOTRIENE E4 COMPLEX AEDES AEGYPTI ODORANT-BINDING PROTEIN ALL-HELICAL SECRETED ALLERGEN
Ref.: MULTIFUNCTIONALITY AND MECHANISM OF LIGAND BINDING MOSQUITO ANTIINFLAMMATORY PROTEIN PROC.NATL.ACAD.SCI.USA V. 106 3728 2009
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CL A:304;
Invalid;
none;
submit data
35.453 Cl [Cl-]
EAH A:305;
Valid;
none;
Kd = 60 nM
320.466 C20 H32 O3 CCCCC...
GOL A:307;
A:308;
A:309;
Invalid;
Invalid;
Invalid;
none;
none;
none;
submit data
92.094 C3 H8 O3 C(C(C...
TRS A:306;
Invalid;
none;
submit data
122.143 C4 H12 N O3 C(C(C...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3DZT 1.8 Å NON-ENZYME: OTHER AED7-LEUKOTRIENE E4 COMPLEX AEDES AEGYPTI ODORANT-BINDING PROTEIN ALL-HELICAL SECRETED ALLERGEN
Ref.: MULTIFUNCTIONALITY AND MECHANISM OF LIGAND BINDING MOSQUITO ANTIINFLAMMATORY PROTEIN PROC.NATL.ACAD.SCI.USA V. 106 3728 2009
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1443 families.
1 3DYE - LNR C8 H11 N O3 c1cc(c(cc1....
2 3DZT Kd = 60 nM EAH C20 H32 O3 CCCCCC=C/C....
70% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1205 families.
1 3DYE - LNR C8 H11 N O3 c1cc(c(cc1....
2 3DZT Kd = 60 nM EAH C20 H32 O3 CCCCCC=C/C....
50% Homology Family (4)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1039 families.
1 3DYE - LNR C8 H11 N O3 c1cc(c(cc1....
2 3DZT Kd = 60 nM EAH C20 H32 O3 CCCCCC=C/C....
3 3NHT Kd = 98 nM U46 C21 H34 O4 CCCCC[C@H]....
4 3NHI - EAH C20 H32 O3 CCCCCC=C/C....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: EAH; Similar ligands found: 7
No: Ligand ECFP6 Tc MDL keys Tc
1 EAH 1 1
2 DJ3 0.506849 0.78125
3 ACD 0.491525 0.884615
4 EIC 0.47541 0.884615
5 RCL 0.434783 0.961538
6 OCR 0.416667 0.925926
7 1AG 0.408451 0.735294
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3DZT; Ligand: EAH; Similar sites found with APoc: 52
This union binding pocket(no: 1) in the query (biounit: 3dzt.bio1) has 23 residues
No: Leader PDB Ligand Sequence Similarity
1 1XMY ROL 0.990099
2 1XM4 PIL 0.990099
3 6CGN DA 1.65016
4 1ZED PNP 1.9802
5 5M67 NAD 2.08768
6 5M67 3D1 2.08768
7 3HYW DCQ 2.31023
8 1SBR VIB 2.5
9 1ZPD CIT 2.9703
10 2ZJ1 ARJ 2.9703
11 2ZJ1 NAD 2.9703
12 5KD8 TNR 2.9703
13 1NU4 MLA 3.09278
14 3ROE THM 3.39623
15 5OLK DTP 3.63036
16 1SW1 PBE 3.63636
17 1B4N GUA 3.9604
18 5IM3 DTP 3.9604
19 2Q0D ATP 3.96601
20 5M37 9SZ 4.34783
21 2BCG GER 4.62046
22 5LX9 OLB 4.9505
23 1CHM CMS 4.9505
24 4M8E 29V 5.19481
25 2ET1 GLV 5.47264
26 3TDC 0EU 5.61056
27 4LOC OXM 5.61056
28 5LX6 78P 5.75916
29 5AZC PGT 6
30 1RJW ETF 6.60066
31 1LNX URI 7.40741
32 4DE2 DN3 7.60456
33 5M36 9SZ 7.89474
34 1YKD CMP 8.0402
35 1R6N 434 8.05687
36 3TL1 JRO 8.1761
37 5UGW GSH 8.57143
38 4O4Z N2O 9.09091
39 2UW1 GVM 10.5611
40 5LWY OLB 12.1495
41 5W7B MYR 13.4752
42 3ISN EDM 14.1914
43 4YSX E23 15.3846
44 4WGF HX2 15.6098
45 3N7S 3N7 16.6667
46 2Y69 CHD 22.093
47 5Z84 CHD 22.3529
48 5ZCO CHD 22.3529
49 5W97 CHD 22.3529
50 2B99 RDL 22.4359
51 4OGQ 7PH 25.8065
52 5V13 JH3 37.5
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