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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 269 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 237 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 187 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 with APoc: 73
This union binding pocket(no: 1) in the query (biounit: 3fp0.bio1) has 21 residues
No: Leader PDB Ligand Sequence Similarity
1 5OES ADP 1.44928
2 4N6H EJ4 1.69082
3 3ZXR IQ1 2.05761
4 3ZXR P3S 2.05761
5 4D4U FUC GAL NAG 2.53968
6 4MPO AMP 2.61438
7 1J3R 6PG 2.63158
8 4OPC PGT 2.86976
9 4OPC FDA 2.86976
10 5LY1 PPI 2.88714
11 5WHT SIA 2.89855
12 3E8N ATP 2.93255
13 3E8N VRA 2.93255
14 2ZI8 SDT 3
15 3VKX T3 3.06513
16 3SAO NKN 3.125
17 4IAW LIZ 3.19149
18 2PCU ASP 3.27869
19 5EW9 5VC 3.32103
20 5OF1 SAL 3.33333
21 3WG3 A2G GAL NAG FUC 3.37079
22 4WOE ADP 3.46821
23 1RQH PYR 3.46821
24 4CJN QNZ 3.66089
25 3WIR BGC 3.66089
26 5VZ0 2BA 3.66089
27 3URB DPF 3.66972
28 3JQA DX4 3.81944
29 1UF5 CDT 3.9604
30 5L2R MLA 4.04624
31 5UN9 NHT 4.16667
32 3TAY MN0 4.29448
33 3ILR SGN IXD 4.32432
34 4PTN GXV 4.37318
35 1NKI PPF 4.44444
36 5HZX 2GE 4.54545
37 1OS1 ATP 4.81696
38 3IX1 NFM 4.96689
39 2Z77 HE7 5.03597
40 3G08 FEE 5.05051
41 1U4J MAN 5.08475
42 5J32 IPM 5.21092
43 1OFZ FUC 5.44872
44 4H6B 10Y 5.64103
45 4H6B 10X 5.64103
46 1KDK DHT 5.64972
47 5TPV TYD 5.88235
48 4ZU4 4TG 6.08108
49 1LSH PLD 6.1657
50 5GLT BGC GAL NAG GAL 6.69014
51 2P7Q GG6 6.76692
52 4H2X G5A 6.79612
53 4H2W 5GP 6.79612
54 4H2W AMP 6.79612
55 5DRB 5FJ 6.87285
56 5J75 6GQ 7.57576
57 4P25 FUC GAL NAG FUC 8.27815
58 1F5F DHT 8.29268
59 5GP0 GPP 8.72483
60 4CNO 9PY 8.73016
61 1OS7 AKG 9.18728
62 2AGC DAO 9.25926
63 5H9P TD2 10.1266
64 2BOS GLA GAL 10.2941
65 1OPB RET 11.194
66 1DZT ATY 11.4754
67 4JH6 FCN 11.5942
68 6GNO XDI 11.8519
69 4Y24 TD2 14.2857
70 4MNS 2AX 17.6101
71 3KFF ZBT 20.3704
72 3KFF XBT 20.3704
73 5LXT ACP 35.6643
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