Receptor
PDB id Resolution Class Description Source Keywords
4S0G 1.72 Å EC: 3.1.3.48 CRYSTAL STRUCTURE OF PTPN3 (PTPH1) IN COMPLEX WITH EPS15 PTY PEPTIDE HOMO SAPIENS ALPHA BETA HYDROLASE HYDROLASE-PROTEIN BINDING COMPLEX
Ref.: SUBSTRATE SPECIFICITY AND PLASTICITY OF FERM-CONTAI PROTEIN TYROSINE PHOSPHATASES STRUCTURE 2015
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
PHE SER ALA PTR VAL SER GLU GLU ASP B:846;
 Valid;
 Atoms found LESS than expected: % Diff = 0.346;
 submit data
735.708 n/a P(=O)...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4RH5 1.6 Å EC: 3.1.3.48 CRYSTAL STRUCTURE OF PTPN3 (PTPH1) IN COMPLEX WITH EPS15 PTY PEPTIDE HOMO SAPIENS ALPHA BETA HYDROLASE HYDROLASE-PROTEIN BINDING COMPLEX
Ref.: SUBSTRATE SPECIFICITY AND PLASTICITY OF FERM-CONTAI PROTEIN TYROSINE PHOSPHATASES. STRUCTURE 2015
Members (4)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 31 families.
1 4S0G - PHE SER ALA PTR VAL SER GLU GLU ASP n/a n/a
2 4RH9 - PHE SER ALA PTR PRO SER GLU GLU ASP n/a n/a
3 4RHG - PHE SER ALA PTR PRO SER GLU GLU ASP n/a n/a
4 4RH5 Kd = 127.3 nM PHE SER ALA PTR PRO SER GLU GLU ASP n/a n/a
70% Homology Family (4)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 28 families.
1 4S0G - PHE SER ALA PTR VAL SER GLU GLU ASP n/a n/a
2 4RH9 - PHE SER ALA PTR PRO SER GLU GLU ASP n/a n/a
3 4RHG - PHE SER ALA PTR PRO SER GLU GLU ASP n/a n/a
4 4RH5 Kd = 127.3 nM PHE SER ALA PTR PRO SER GLU GLU ASP 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 18 families.
1 4S0G - PHE SER ALA PTR VAL SER GLU GLU ASP n/a n/a
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: PHE SER ALA PTR VAL SER GLU GLU ASP; Similar ligands found: 24
No: Ligand ECFP6 Tc MDL keys Tc
1 PHE SER ALA PTR VAL SER GLU GLU ASP 1 1
2 PHE SER ALA PTR PRO SER GLU GLU ASP 0.622951 0.757143
3 SER PTR VAL ASN VAL GLN ASN 0.491803 0.883333
4 ALA PHE THR SER 0.485437 0.727273
5 ARG VAL ILE PTR PHE VAL PRO LEU ASN ARG 0.449612 0.680556
6 GLY GLU ALA TPO VAL PTR ALA 0.445312 0.819672
7 SER LEU PHE ASN THR VAL ALA THR LEU TYR 0.445255 0.810345
8 PHE LEU SER THR LYS 0.441667 0.688525
9 SER LEU PHE ASN THR ILE ALA VAL LEU 0.441176 0.7
10 LEU PTR LEU 0.441176 0.821429
11 PTR LEU ARG VAL ALA 0.433071 0.727273
12 LYS PRO PHE PTR VAL ASN VAL NH2 0.431507 0.712329
13 VAL ALA PHE ARG SER 0.429752 0.609375
14 PHE LEU ALA TYR LYS 0.427419 0.677419
15 PHE LEU ARG GLY ARG ALA TYR VAL LEU 0.42069 0.647059
16 ARG LEU ASN PTR ALA GLN LEU TRP HIS ARG 0.420635 0.827586
17 SER SER LEU GLU ASN PHE ALA ALA TYR VAL 0.41844 0.770492
18 SER PHE ALA ASN GLY 0.417391 0.65
19 ASN ALA ARG SER ALA SEP PHE SER GLN GLY 0.417323 0.734375
20 ALA GLU THR PHE TYR VAL ASP GLY 0.414062 0.745763
21 SER LEU PHE ASN THR VAL ALA THR LEU 0.406015 0.711864
22 PHE LEU SER TYR LYS 0.404762 0.741935
23 GLU VAL PTR GLU SER PRO 0.404412 0.722222
24 ALA PRO SER PTR VAL ASN VAL GLN ASN 0.401361 0.716216
Similar Ligands (3D)
Ligand no: 1; Ligand: PHE SER ALA PTR VAL SER GLU GLU ASP; Similar ligands found: 0
No: Ligand Similarity coefficient
Similar Binding Sites (Proteins are less than 50% similar to leader) APoc FAQ
Feedback