Receptor
PDB id Resolution Class Description Source Keywords
3Q78 2.2 Å EC: 2.-.-.- CRYPTOCOCCUS NEOFORMANS PROTEIN FARNESYLTRANSFERASE IN COMPL FSPP AND DDPTASACNIQ PEPTIDE CRYPTOCOCCUS NEOFORMANS PROTEIN PRENYLTRANSFERASE TRANSFERASE
Ref.: STRUCTURES OF CRYPTOCOCCUS NEOFORMANS PROTEIN FARNESYLTRANSFERASE REVEAL STRATEGIES FOR DEVELOPIN INHIBITORS THAT TARGET FUNGAL PATHOGENS. J.BIOL.CHEM. V. 286 35149 2011
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
3CX B:522;
B:523;
Invalid;
Invalid;
none;
none;
submit data
237.316 C9 H19 N O4 S C1CCC...
FPS B:524;
Valid;
none;
submit data
398.392 C15 H28 O6 P2 S CC(=C...
ZN B:521;
Part of Protein;
none;
submit data
65.409 Zn [Zn+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3Q78 2.2 Å EC: 2.-.-.- CRYPTOCOCCUS NEOFORMANS PROTEIN FARNESYLTRANSFERASE IN COMPL FSPP AND DDPTASACNIQ PEPTIDE CRYPTOCOCCUS NEOFORMANS PROTEIN PRENYLTRANSFERASE TRANSFERASE
Ref.: STRUCTURES OF CRYPTOCOCCUS NEOFORMANS PROTEIN FARNESYLTRANSFERASE REVEAL STRATEGIES FOR DEVELOPIN INHIBITORS THAT TARGET FUNGAL PATHOGENS. J.BIOL.CHEM. V. 286 35149 2011
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 313 families.
1 3Q78 - FPS C15 H28 O6 P2 S CC(=CCC/C(....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 277 families.
1 3Q78 - FPS C15 H28 O6 P2 S CC(=CCC/C(....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 212 families.
1 3Q78 - FPS C15 H28 O6 P2 S CC(=CCC/C(....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: FPS; Similar ligands found: 28
No: Ligand ECFP6 Tc MDL keys Tc
1 GGS 1 1
2 FPS 1 1
3 GST 0.911111 0.975
4 AG8 0.701754 0.816327
5 DST 0.5625 0.85
6 OTP 0.551724 0.860465
7 ZTP 0.551724 0.860465
8 VTP 0.551724 0.860465
9 FPP 0.551724 0.880952
10 GRG 0.551724 0.880952
11 0K3 0.54717 0.790698
12 FJP 0.54717 0.809524
13 DSL 0.54717 0.790698
14 HZZ 0.490566 0.785714
15 GPP 0.482759 0.857143
16 FFF 0.476923 0.822222
17 FHP 0.473684 0.704545
18 FGG 0.469697 0.822222
19 ELR 0.455882 0.840909
20 ELU 0.455882 0.840909
21 2CF 0.454545 0.822222
22 FPF 0.454545 0.822222
23 MGM 0.449275 0.685185
24 3E9 0.441176 0.840909
25 FPQ 0.426471 0.734694
26 FII 0.41791 0.6
27 PS7 0.405063 0.804348
28 749 0.403509 0.875
Similar Ligands (3D)
Ligand no: 1; Ligand: FPS; Similar ligands found: 0
No: Ligand Similarity coefficient
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3Q78; Ligand: FPS; Similar sites found with APoc: 4
This union binding pocket(no: 1) in the query (biounit: 3q78.bio1) has 22 residues
No: Leader PDB Ligand Sequence Similarity
1 4L9P FII 47.5645
2 1MZC FPP 48.5126
3 1MZC BNE 48.5126
4 1KZO FPP 48.8064
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