Receptor
PDB id Resolution Class Description Source Keywords
3U3U 2.5 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF THE TABLYSIN-15-LEUKOTRIENE E4 COMPLEX TABANUS YAO CAP DOMAIN BINDING PROTEIN INTEGRIN ALPHAVBETA3 AND LEUKOTPROTEIN BINDING
Ref.: STRUCTURE OF PROTEIN HAVING INHIBITORY DISINTEGRIN LEUKOTRIENE SCAVENGING FUNCTIONS CONTAINED IN SINGL J.BIOL.CHEM. V. 287 10967 2012
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CIT C:234;
C:235;
Invalid;
Invalid;
none;
none;
submit data
192.124 C6 H8 O7 C(C(=...
EAH C:236;
Valid;
none;
Kd = 133.3 nM
320.466 C20 H32 O3 CCCCC...
PR C:233;
Invalid;
none;
submit data
140.908 Pr [Pr+3...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3U3U 2.5 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF THE TABLYSIN-15-LEUKOTRIENE E4 COMPLEX TABANUS YAO CAP DOMAIN BINDING PROTEIN INTEGRIN ALPHAVBETA3 AND LEUKOTPROTEIN BINDING
Ref.: STRUCTURE OF PROTEIN HAVING INHIBITORY DISINTEGRIN LEUKOTRIENE SCAVENGING FUNCTIONS CONTAINED IN SINGL J.BIOL.CHEM. V. 287 10967 2012
Members (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1443 families.
1 3U3U Kd = 133.3 nM EAH C20 H32 O3 CCCCCC=C/C....
2 3U3L - PLM C16 H32 O2 CCCCCCCCCC....
3 3U3N - PLM C16 H32 O2 CCCCCCCCCC....
70% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1205 families.
1 3U3U Kd = 133.3 nM EAH C20 H32 O3 CCCCCC=C/C....
2 3U3L - PLM C16 H32 O2 CCCCCCCCCC....
3 3U3N - PLM C16 H32 O2 CCCCCCCCCC....
50% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1039 families.
1 3U3U Kd = 133.3 nM EAH C20 H32 O3 CCCCCC=C/C....
2 3U3L - PLM C16 H32 O2 CCCCCCCCCC....
3 3U3N - PLM C16 H32 O2 CCCCCCCCCC....
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 : 3U3U; Ligand: EAH; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 1) in the query (biounit: 3u3u.bio1) has 21 residues
No: Leader PDB Ligand Sequence Similarity
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