Receptor
PDB id Resolution Class Description Source Keywords
3HNB 1.15 Å NON-ENZYME: OTHER FACTOR VIII TRP2313-HIS2315 SEGMENT IS INVOLVED IN MEMBRANE SHOWN BY CRYSTAL STRUCTURE OF COMPLEX BETWEEN FACTOR VIII CA ND AN INHIBITOR HOMO SAPIENS SMALL MOLECULE INHIBITOR/BLOOD CLOTTING BLOOD CLOTTING
Ref.: TRP2313-HIS2315 OF FACTOR VIII C2 DOMAIN IS INVOLVE MEMBRANE BINDING: STRUCTURE OF A COMPLEX BETWEEN TH DOMAIN AND AN INHIBITOR OF MEMBRANE BINDING. J.BIOL.CHEM. V. 285 8824 2010
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
768 M:1;
 Valid;
 none;
 submit data
463.4 C23 H28 Cl2 N4 O2 [H]/N...
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90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3HNB 1.15 Å NON-ENZYME: OTHER FACTOR VIII TRP2313-HIS2315 SEGMENT IS INVOLVED IN MEMBRANE SHOWN BY CRYSTAL STRUCTURE OF COMPLEX BETWEEN FACTOR VIII CA ND AN INHIBITOR HOMO SAPIENS SMALL MOLECULE INHIBITOR/BLOOD CLOTTING BLOOD CLOTTING
Ref.: TRP2313-HIS2315 OF FACTOR VIII C2 DOMAIN IS INVOLVE MEMBRANE BINDING: STRUCTURE OF A COMPLEX BETWEEN TH DOMAIN AND AN INHIBITOR OF MEMBRANE BINDING. J.BIOL.CHEM. V. 285 8824 2010
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1610 families.
1 3HNB - 768 C23 H28 Cl2 N4 O2 [H]/N=C/1N....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1331 families.
1 3HNB - 768 C23 H28 Cl2 N4 O2 [H]/N=C/1N....
50% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1144 families.
1 3HNB - 768 C23 H28 Cl2 N4 O2 [H]/N=C/1N....
2 7JJC Kd = 13 uM ASN SER PRO ARG ARG ALA ARG n/a n/a
3 6FMC Kd = 1.32 uM DUE C26 H28 N6 O6 S2 [H]/N=C(/N....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: 768; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 768 1 1
Similar Ligands (3D)
Ligand no: 1; Ligand: 768; Similar ligands found: 0
No: Ligand Similarity coefficient
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3HNB; Ligand: 768; 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: 3hnb.bio1) has 7 residues
No: Leader PDB Ligand Sequence Similarity
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