Receptor
PDB id Resolution Class Description Source Keywords
1HPG 1.5 Å EC: 3.4.21.82 A GLUTAMIC ACID SPECIFIC SERINE PROTEASE UTILIZES A NOVEL HI TRIAD IN SUBSTRATE BINDING STREPTOMYCES GRISEUS SERINE PROTEASE HYDROLASE-HYDROLASE INHIBITOR COMPLEX
Ref.: A GLUTAMIC ACID SPECIFIC SERINE PROTEASE UTILIZES A HISTIDINE TRIAD IN SUBSTRATE BINDING. BIOCHEMISTRY V. 32 11469 1993
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
BOC ALA ALA PRO GLU B:300;
Valid;
none;
submit data
485.514 n/a O=C(O...
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90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1HPG 1.5 Å EC: 3.4.21.82 A GLUTAMIC ACID SPECIFIC SERINE PROTEASE UTILIZES A NOVEL HI TRIAD IN SUBSTRATE BINDING STREPTOMYCES GRISEUS SERINE PROTEASE HYDROLASE-HYDROLASE INHIBITOR COMPLEX
Ref.: A GLUTAMIC ACID SPECIFIC SERINE PROTEASE UTILIZES A HISTIDINE TRIAD IN SUBSTRATE BINDING. BIOCHEMISTRY V. 32 11469 1993
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 1HPG - BOC ALA ALA PRO GLU n/a n/a
70% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 1HPG - BOC ALA ALA PRO GLU n/a n/a
2 5SGA - ACE PRO ALA PRO TYR n/a n/a
3 4SGA Ki = 50 nM ACE PRO ALA PRO PHE n/a n/a
50% Homology Family (4)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 1HPG - BOC ALA ALA PRO GLU n/a n/a
2 5SGA - ACE PRO ALA PRO TYR n/a n/a
3 4SGA Ki = 50 nM ACE PRO ALA PRO PHE n/a n/a
4 2OUA - AES C8 H10 F N O2 S c1cc(ccc1C....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: BOC ALA ALA PRO GLU; Similar ligands found: 11
No: Ligand ECFP6 Tc MDL keys Tc
1 BOC ALA ALA PRO GLU 1 1
2 BOC ALA ALA PRO PVA 0.643678 0.84375
3 BOC ALA ALA PRO PVA LAC ALA 0.622449 0.84375
4 SER GLU CYS THR THR PRO CYS 0.429825 0.769231
5 SIN ALA ALA PRO PHE NIT 0.42623 0.675676
6 LEU PRO GLU THR GLY 0.420561 0.809524
7 PRO GLU PRO THR ALA PRO PRO GLU GLU 0.419355 0.784615
8 PRO GLU ALA THR ALA PRO PRO GLU GLU 0.414634 0.784615
9 ACE ALA PRO ALA 0.413793 0.789474
10 LYS PRO LYS 0.410526 0.762712
11 ACE PRO ALA PRO TYR 0.409524 0.727273
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1HPG; Ligand: BOC ALA ALA PRO GLU; 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: 1hpg.bio1) has 17 residues
No: Leader PDB Ligand Sequence Similarity
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