Receptor
PDB id Resolution Class Description Source Keywords
3FP0 1.9 Å EC: 2.-.-.- STRUCTURAL AND FUNCTIONAL CHARACTERIZATION OF TRI3 TRICHOTHECENE 15-O-ACETYLTRANSFERASE FROM FUSARIUM S POROTRICHIOIDES FUSARIUM SPOROTRICHIOIDES FUSARIUM HEAD BLIGHT TRICHOTHECENE MYCOTOXIN DEOXYNIVALENOL T-2 TOXIN FUSARIUM GRAMINEARUM FUSARIUM SPOROTRICHIOIDES ACETYLTRANSFERASE COENZYME A BAHD SUPERFAMILY TRANSFERASE
Ref.: STRUCTURAL AND FUNCTIONAL CHARACTERIZATION OF TRI3 TRICHOTHECENE 15-O-ACETYLTRANSFERASE FROM FUSARIUM SPOROTRICHIOIDES PROTEIN SCI. V. 18 747 2009
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
EPE A:522;
Invalid;
none;
submit data
238.305 C8 H18 N2 O4 S C1CN(...
FP0 A:520;
Valid;
none;
submit data
308.369 C17 H24 O5 CC1=C...
SWE A:521;
Invalid;
none;
submit data
342.296 C12 H22 O11 C([C@...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3FP0 1.9 Å EC: 2.-.-.- STRUCTURAL AND FUNCTIONAL CHARACTERIZATION OF TRI3 TRICHOTHECENE 15-O-ACETYLTRANSFERASE FROM FUSARIUM S POROTRICHIOIDES FUSARIUM SPOROTRICHIOIDES FUSARIUM HEAD BLIGHT TRICHOTHECENE MYCOTOXIN DEOXYNIVALENOL T-2 TOXIN FUSARIUM GRAMINEARUM FUSARIUM SPOROTRICHIOIDES ACETYLTRANSFERASE COENZYME A BAHD SUPERFAMILY TRANSFERASE
Ref.: STRUCTURAL AND FUNCTIONAL CHARACTERIZATION OF TRI3 TRICHOTHECENE 15-O-ACETYLTRANSFERASE FROM FUSARIUM SPOROTRICHIOIDES PROTEIN SCI. V. 18 747 2009
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 236 families.
1 3FP0 - FP0 C17 H24 O5 CC1=C[C@@H....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 211 families.
1 3FP0 - FP0 C17 H24 O5 CC1=C[C@@H....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 166 families.
1 3FP0 - FP0 C17 H24 O5 CC1=C[C@@H....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: FP0; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 FP0 1 1
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3FP0; Ligand: FP0; Similar sites found: 19
This union binding pocket(no: 1) in the query (biounit: 3fp0.bio1) has 21 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 4MPO AMP 0.02768 0.40727 2.61438
2 4OPC FDA 0.04302 0.41725 2.86976
3 4OPC PGT 0.04836 0.41725 2.86976
4 3E8N VRA 0.02739 0.40081 2.93255
5 3E8N ATP 0.02739 0.40081 2.93255
6 4IAW LIZ 0.01283 0.40663 3.19149
7 3JQA DX4 0.0172 0.41636 3.81944
8 3TAY MN0 0.00278 0.4296 4.29448
9 1OS1 ATP 0.01244 0.40186 4.81696
10 3G08 FEE 0.02388 0.41068 5.05051
11 4H6B 10Y 0.009356 0.41327 5.64103
12 4H6B 10X 0.01188 0.40423 5.64103
13 4H2W 5GP 0.004228 0.4052 6.79612
14 4H2W AMP 0.003847 0.40225 6.79612
15 5DRB 5FJ 0.01994 0.40823 6.87285
16 1OPB RET 0.007619 0.40042 11.194
17 4JH6 FCN 0.01518 0.40722 11.5942
18 4MNS 2AX 0.003695 0.44568 17.6101
19 5LXT ACP 0.007932 0.40313 35.6643
Feedback