Receptor
PDB id Resolution Class Description Source Keywords
4Z5W 2.2 Å NON-ENZYME: SIGNAL_HORMONE THE PLANT PEPTIDE HORMONE RECEPTOR DAUCUS CAROTA RECEPTOR HORMONE
Ref.: ALLOSTERIC RECEPTOR ACTIVATION BY THE PLANT PEPTIDE PHYTOSULFOKINE NATURE V. 525 265 2015
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
NAG B:704;
A:703;
B:707;
B:708;
B:706;
A:702;
B:705;
B:703;
A:701;
A:705;
A:704;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
221.208 C8 H15 N O6 CC(=O...
TYS ILE TYS THR GLN Q:28;
P:28;
Valid;
Valid;
none;
none;
Kd = 4.2 nM
844.873 n/a S(=O)...
NAG NAG B:701;
Invalid;
none;
submit data
408.404 n/a O=C(N...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4Z5W 2.2 Å NON-ENZYME: SIGNAL_HORMONE THE PLANT PEPTIDE HORMONE RECEPTOR DAUCUS CAROTA RECEPTOR HORMONE
Ref.: ALLOSTERIC RECEPTOR ACTIVATION BY THE PLANT PEPTIDE PHYTOSULFOKINE NATURE V. 525 265 2015
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 286 families.
1 4Z5W Kd = 4.2 nM TYS ILE TYS THR GLN 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 209 families.
1 4Z5W Kd = 4.2 nM TYS ILE TYS THR GLN 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 174 families.
1 4Z5W Kd = 4.2 nM TYS ILE TYS THR GLN n/a n/a
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: TYS ILE TYS THR GLN; Similar ligands found: 13
No: Ligand ECFP6 Tc MDL keys Tc
1 TYS ILE TYS THR GLN 1 1
2 ALA ILE PHE GLN SER SER MET THR LYS 0.472441 0.6
3 ASP ILE ASN TYS TYS THR SER GLU PRO 0.469697 0.792683
4 TYR ASP GLN ILE LEU 0.459459 0.666667
5 GLY ILE LEU GLU PHE VAL PHE THR LEU 0.435484 0.652174
6 LYS VAL ILE THR PHE ILE ASP LEU 0.428571 0.619718
7 SER LEU TYR ASN THR ILE ALA THR LEU 0.420635 0.657143
8 LEU ALA ILE TYR SER 0.419643 0.608696
9 SER PTR VAL ASN VAL GLN ASN 0.418033 0.732394
10 GLY ILE LEU GLY LEU VAL PHE THR LEU 0.416 0.6
11 ASP ILE ASN TYR TYR THR SER GLU PRO 0.410072 0.609756
12 TYR GLN GLU SER THR ASP PHE THR PHE LEU 0.401786 0.651515
13 PHE LEU THR GLY ILE GLY ILE ILE THR VAL 0.401639 0.623188
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 4Z5W; Ligand: TYS ILE TYS THR GLN; 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: 4z5w.bio2) has 27 residues
No: Leader PDB Ligand Sequence Similarity
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