Receptor
PDB id Resolution Class Description Source Keywords
1ZVR 1.98 Å EC: 3.1.3.- CRYSTAL STRUCTURE OF MTMR2 IN COMPLEX WITH PHOSPHATIDYLINOSI BISPHOSPHATE HOMO SAPIENS PROTEIN-PHOSPHOINOSITIDE COMPLEX HYDROLASE
Ref.: MOLECULAR BASIS FOR SUBSTRATE RECOGNITION BY MTMR2, MYOTUBULARIN FAMILY PHOSPHOINOSITIDE PHOSPHATASE PROC.NATL.ACAD.SCI.USA V. 103 927 2006
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
3PI A:3632;
 Valid;
 none;
 submit data
636.37 C17 H35 O19 P3 CCC[C...
EDO A:1878;
A:1879;
A:1880;
 Invalid;
Invalid;
Invalid;
 none;
none;
none;
 submit data
62.068 C2 H6 O2 C(CO)...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1ZSQ 1.82 Å EC: 3.1.3.- CRYSTAL STRUCTURE OF MTMR2 IN COMPLEX WITH PHOSPHATIDYLINOSITOL 3-PHOSPHATE HOMO SAPIENS PROTEIN-PHOSPHOLIPID COMPLEX HYDROLASE
Ref.: MOLECULAR BASIS FOR SUBSTRATE RECOGNITION BY MTMR2, A MYOTUBULARIN FAMILY PHOSPHOINOSITIDE PHOSPHATASE PROC.NATL.ACAD.SCI.USA V. 103 927 2006
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 8 families.
1 1ZVR - 3PI C17 H35 O19 P3 CCC[C@H](O....
2 1ZSQ - PIB C17 H32 O16 P2 CCCC(=O)OC....
70% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 7 families.
1 1ZVR - 3PI C17 H35 O19 P3 CCC[C@H](O....
2 1ZSQ - PIB C17 H32 O16 P2 CCCC(=O)OC....
50% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 7 families.
1 1ZVR - 3PI C17 H35 O19 P3 CCC[C@H](O....
2 1ZSQ - PIB C17 H32 O16 P2 CCCC(=O)OC....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: 3PI; Similar ligands found: 13
No: Ligand ECFP6 Tc MDL keys Tc
1 3PI 1 1
2 I35 0.695652 0.978261
3 5P5 0.613333 0.957447
4 PIB 0.613333 0.957447
5 DB4 0.60274 0.957447
6 PBU 0.571429 0.957447
7 4PT 0.536585 0.978723
8 IP9 0.482759 0.918367
9 PIF 0.482353 0.9
10 PIZ 0.477273 0.918367
11 52N 0.465909 0.9
12 PIO 0.465909 0.9
13 PII 0.425287 0.88
Similar Ligands (3D)
Ligand no: 1; Ligand: 3PI; 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 : 1ZSQ; Ligand: PIB; 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: 1zsq.bio1) has 23 residues
No: Leader PDB Ligand Sequence Similarity
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