Receptor
PDB id Resolution Class Description Source Keywords
3upv 1.6 Å NON-ENZYME: OTHER TPR2B-DOMAIN:PHSP70-COMPLEX OF YEAST STI1 SACCHAROMYCES CEREVISIAE TPR-FOLD ADAPTOR PROTEIN FOR HSP70 AND HSP90 C-TERMINAL PAHSP70 PEPTIDE BINDING PROTEIN
Ref.: THE ARCHITECTURE OF FUNCTIONAL MODULES IN THE HSP90 CO-CHAPERONE STI1/HOP. EMBO J. V. 31 1506 2012
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
PRO THR VAL GLU GLU VAL ASP B:650;
 Valid;
 none;
 Kd = 5 uM
784.797 n/a O=C([...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3UPV 1.6 Å NON-ENZYME: OTHER TPR2B-DOMAIN:PHSP70-COMPLEX OF YEAST STI1 SACCHAROMYCES CEREVISIAE TPR-FOLD ADAPTOR PROTEIN FOR HSP70 AND HSP90 C-TERMINAL PAHSP70 PEPTIDE BINDING PROTEIN
Ref.: THE ARCHITECTURE OF FUNCTIONAL MODULES IN THE HSP90 CO-CHAPERONE STI1/HOP. EMBO J. V. 31 1506 2012
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1610 families.
1 3UPV Kd = 5 uM PRO THR VAL GLU GLU VAL ASP 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 1331 families.
1 3UPV Kd = 5 uM PRO THR VAL GLU GLU VAL 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 1144 families.
1 3UPV Kd = 5 uM PRO THR VAL GLU GLU VAL ASP n/a n/a
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: PRO THR VAL GLU GLU VAL ASP; Similar ligands found: 24
No: Ligand ECFP6 Tc MDL keys Tc
1 PRO THR VAL GLU GLU VAL ASP 1 1
2 PRO THR SER SER GLU GLN ILE 0.625 0.925926
3 ACE MET GLU GLU VAL ASP 0.516854 0.631579
4 LEU PRO PRO PRO GLU SER GLU SER LYS VAL 0.515152 0.943396
5 ACE THR GLU ASP VAL VAL CYS CYS 0.494845 0.788462
6 ASP THR GLU MET GLU GLU VAL ASP 0.489362 0.649123
7 PRO THR LEU VAL 0.482353 0.87037
8 GLY SER LYS MET GLU GLU VAL ASP 0.462264 0.775862
9 ACE ASP GLU VAL ASP 0QE 0.461538 0.685185
10 ACE PRO VAL GLN GLU THR NH2 0.457143 0.830508
11 PRO GLU ALA THR ALA PRO PRO GLU GLU 0.453782 0.833333
12 THR PRO THR ARG ASP VAL ALA THR SER PRO 0.448 0.772727
13 PRO GLU PRO THR ALA PRO PRO GLU GLU 0.446281 0.833333
14 ALA GLU ASP ASP VAL GLU 0.43956 0.711538
15 GLU PRO VAL GLU THR THR ASP TYR 0.435484 0.806452
16 ASN ASN LEU GLN ASP GLY THR GLU VAL 0.431818 0.823529
17 PRO THR GLU PUK ARG GLU 0.431818 0.774194
18 SER ARG MET GLU GLU VAL ASP 0.431193 0.724138
19 PRO ILE VAL 0.425287 0.830189
20 PRO ALA TRP ASP GLU THR ASN LEU 0.419118 0.85
21 PRO HIS THR ASN GLU THR SEP LEU 0.413534 0.761194
22 PRO SER ARG VAL 0.411765 0.827586
23 PRO VAL LYS ARG ARG LEU ASP LEU GLU 0.409449 0.79661
24 ACE ASP GLU VAL ASP ASP GLU VAL ASP 0.408602 0.660377
Similar Ligands (3D)
Ligand no: 1; Ligand: PRO THR VAL GLU GLU VAL ASP; 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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