Receptor
PDB id Resolution Class Description Source Keywords
5T63 2.5 Å EC: 3.-.-.- THE HHOA PROTEASE FROM SYNECHOCYSTIS SP. PCC 6803 SYNECHOCYSTIS SP. PCC 6803 SUBSTR. KAZORGANISM_TAXID: 1111708 PROTEASE PDZ DOMAIN HYDROLASE
Ref.: THE HHOA PROTEASE FROM SYNECHOCYSTIS SP. PCC 6803 -INSIGHTS INTO STRUCTURE AND ACTIVITY REGULATION. J. STRUCT. BIOL. V. 198 147 2017
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
MG A:401;
 Invalid;
 none;
 submit data
24.305 Mg [Mg+2...
ALA ALA ALA ALA C:1;
 Valid;
 none;
 submit data
287.34 n/a O=C(N...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5T63 2.5 Å EC: 3.-.-.- THE HHOA PROTEASE FROM SYNECHOCYSTIS SP. PCC 6803 SYNECHOCYSTIS SP. PCC 6803 SUBSTR. KAZORGANISM_TAXID: 1111708 PROTEASE PDZ DOMAIN HYDROLASE
Ref.: THE HHOA PROTEASE FROM SYNECHOCYSTIS SP. PCC 6803 -INSIGHTS INTO STRUCTURE AND ACTIVITY REGULATION. J. STRUCT. BIOL. V. 198 147 2017
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 312 families.
1 5T63 - ALA ALA ALA ALA n/a n/a
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 261 families.
1 5T63 - ALA ALA ALA ALA n/a n/a
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 214 families.
1 5T63 - ALA ALA ALA ALA n/a n/a
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: ALA ALA ALA ALA; Similar ligands found: 19
No: Ligand ECFP6 Tc MDL keys Tc
1 ALA ALA ALA ALA ALA 1 1
2 ALA ALA ALA ALA 1 1
3 ALA LEU SER ARG GLN 0.659574 0.666667
4 ALA LEU SER ARG 0.617021 0.666667
5 ALA ALA ALA ALA ALA ALA ALA 0.615385 0.923077
6 ALA ALA SER ALA SER ALA 0.591837 0.648649
7 ALA ALA ALA 0.589744 0.923077
8 ALA GLY GLY ALA ALA ALA ALA ALA 0.566038 0.705882
9 ALA GLY ALA ALA 0.541667 0.727273
10 ALA LYS ALA ALA 0.537037 0.685714
11 ALA VAL ALA 0.5 0.92
12 ILE GLY LEU TRP LYS SER 0.491228 0.666667
13 DAL DAL 0.461538 0.846154
14 ALA GLU ALA ALA GLN ALA 0.460317 0.705882
15 ALA ALA ALA ALA SER ALA ALA 0.45283 0.648649
16 ALA THR ALA ALA 0.44 0.774194
17 LYS TYR PRO PHE VAL GLU PRO ILE 0.431818 0.724138
18 ALA ALA PHE 0.421053 0.766667
19 ALA ALA CE7 0.42 0.666667
Similar Ligands (3D)
Ligand no: 1; Ligand: ALA ALA ALA ALA; Similar ligands found: 5
No: Ligand Similarity coefficient
1 KGT 0.9036
2 SER THR SER ALA 0.8930
3 GLY ALA THR VAL 0.8842
4 GSH 0.8738
5 2YJ 0.8631
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 5T63; Ligand: ALA ALA ALA ALA; 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: 5t63.bio1) has 8 residues
No: Leader PDB Ligand Sequence Similarity
APoc FAQ
Feedback