Receptor
PDB id Resolution Class Description Source Keywords
2I6O 1.9 Å EC: 3.1.3.48 CRYSTAL STRUCTURE OF THE COMPLEX OF THE ARCHAEAL SULFOLOBUS PTP-FOLD PHOSPHATASE WITH PHOSPHOPEPTIDES N-G-(P)Y-K-N SULFOLOBUS SOLFATARICUS PTP DOMAIN TYROSINE PHOSPHATASE HYDROLASE
Ref.: ENZYME-SUBSTRATE INTERACTIONS REVEALED BY THE CRYSTAL STRUCTURES OF THE ARCHAEAL SULFOLOBUS PTP-FOLD PHOSPHATASE AND ITS PHOSPHOPEPTIDE COMPLEXES PROTEINS V. 66 996 2006
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ASN LYS PTR GLY ASN CA B:171;
 Valid;
 none;
 submit data
713.675 n/a P(=O)...
IMD B:1305;
B:1306;
B:1307;
 Invalid;
Invalid;
Invalid;
 none;
none;
none;
 submit data
69.085 C3 H5 N2 c1c[n...
PG4 A:901;
B:900;
 Invalid;
Invalid;
 none;
none;
 submit data
194.226 C8 H18 O5 C(COC...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2I6O 1.9 Å EC: 3.1.3.48 CRYSTAL STRUCTURE OF THE COMPLEX OF THE ARCHAEAL SULFOLOBUS PTP-FOLD PHOSPHATASE WITH PHOSPHOPEPTIDES N-G-(P)Y-K-N SULFOLOBUS SOLFATARICUS PTP DOMAIN TYROSINE PHOSPHATASE HYDROLASE
Ref.: ENZYME-SUBSTRATE INTERACTIONS REVEALED BY THE CRYSTAL STRUCTURES OF THE ARCHAEAL SULFOLOBUS PTP-FOLD PHOSPHATASE AND ITS PHOSPHOPEPTIDE COMPLEXES PROTEINS V. 66 996 2006
Members (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 31 families.
1 2DXP - ALA PTR ARG n/a n/a
2 2I6P - 4NP C6 H6 N O6 P c1cc(ccc1[....
3 2I6O - ASN LYS PTR GLY ASN CA 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 28 families.
1 2DXP - ALA PTR ARG n/a n/a
2 2I6P - 4NP C6 H6 N O6 P c1cc(ccc1[....
3 2I6O - ASN LYS PTR GLY ASN CA n/a n/a
50% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 18 families.
1 2DXP - ALA PTR ARG n/a n/a
2 2I6P - 4NP C6 H6 N O6 P c1cc(ccc1[....
3 2I6O - ASN LYS PTR GLY ASN CA n/a n/a
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: ASN LYS PTR GLY ASN CA; Similar ligands found: 17
No: Ligand ECFP6 Tc MDL keys Tc
1 ASN LYS PTR GLY ASN CA 1 1
2 SER PTR VAL ASN VAL GLN ASN 0.466667 0.83871
3 ASP GLU PTR GLU ASN VAL ASP 0.466102 0.864407
4 ALA PTR ARG 0.462963 0.806452
5 SEP GLN GLU PTR 0.4375 0.862069
6 GLY GLY LYS LYS LYS TYR LYS LEU 0.434783 0.709677
7 GLY GLY LYS LYS LYS TYR GLN LEU 0.429752 0.709677
8 VAL LYS VAL VAL ALA LYS LYS TYR ARG ASN 0.427419 0.712121
9 ACE PTR GLU GLU GLY 0.425926 0.87931
10 GLY GLY LYS LYS LYS TYR ARG LEU 0.424 0.671642
11 GLY GLY LYS LYS ARG TYR LYS LEU 0.424 0.671642
12 GLY GLY ARG LYS LYS TYR LYS LEU 0.424 0.671642
13 CYS THR PHE LYS THR LYS THR ASN 0.416667 0.709677
14 GLN VAL ASN PHE LEU GLY LYS 0.415385 0.704918
15 ASP GLY PTR MET PRO 0.410853 0.760563
16 THR PHE LYS LYS THR ASN 0.410256 0.721311
17 GLN TYR PHE MET TPO GLU PTR VAL ALA 0.401316 0.779412
Similar Ligands (3D)
Ligand no: 1; Ligand: ASN LYS PTR GLY ASN CA; Similar ligands found: 0
No: Ligand Similarity coefficient
Similar Binding Sites (Proteins are less than 50% similar to leader) APoc FAQ
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