Receptor
PDB id Resolution Class Description Source Keywords
2CFU 1.9 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF SDSA1, AN ALKYLSULFATASE FROM PSEUDOMONAS AERUGINOSA, IN COMPLEX WITH 1-DECANE-SULFONIC- A CID. PSEUDOMONAS AERUGINOSA SDS-HYDROLASE SDSA1 LACTAMASE HYDROLASE
Ref.: THE CRYSTAL STRUCTURE OF SDSA1, AN ALKYLSULFATASE F PSEUDOMONAS AERUGINOSA, DEFINES A THIRD CLASS OF SULFATASES. PROC.NATL.ACAD.SCI.USA V. 103 7631 2006
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
1DB A:1655;
Valid;
none;
submit data
222.345 C10 H22 O3 S CCCCC...
IPA A:1664;
Invalid;
none;
submit data
60.095 C3 H8 O CC(C)...
PEG A:1656;
A:1657;
A:1658;
A:1659;
A:1660;
A:1661;
A:1662;
A:1663;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
106.12 C4 H10 O3 C(COC...
ZN A:1001;
A:1002;
Part of Protein;
Part of Protein;
none;
none;
submit data
65.409 Zn [Zn+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2CFU 1.9 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF SDSA1, AN ALKYLSULFATASE FROM PSEUDOMONAS AERUGINOSA, IN COMPLEX WITH 1-DECANE-SULFONIC- A CID. PSEUDOMONAS AERUGINOSA SDS-HYDROLASE SDSA1 LACTAMASE HYDROLASE
Ref.: THE CRYSTAL STRUCTURE OF SDSA1, AN ALKYLSULFATASE F PSEUDOMONAS AERUGINOSA, DEFINES A THIRD CLASS OF SULFATASES. PROC.NATL.ACAD.SCI.USA V. 103 7631 2006
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1610 families.
1 2CFU - 1DB C10 H22 O3 S CCCCCCCCCC....
2 2CFZ - 1DO C12 H26 O CCCCCCCCCC....
70% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1331 families.
1 2CFU - 1DB C10 H22 O3 S CCCCCCCCCC....
2 2CFZ - 1DO C12 H26 O CCCCCCCCCC....
50% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1144 families.
1 2CFU - 1DB C10 H22 O3 S CCCCCCCCCC....
2 2CFZ - 1DO C12 H26 O CCCCCCCCCC....
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: 1DB; Similar ligands found: 3
No: Ligand ECFP6 Tc MDL keys Tc
1 HDS 1 1
2 1DB 1 1
3 C15 0.512821 0.735849
Similar Ligands (3D)
Ligand no: 1; Ligand: 1DB; Similar ligands found: 3
No: Ligand Similarity coefficient
1 BOW 0.8737
2 U4G 0.8684
3 CBH 0.8680
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2CFU; Ligand: 1DB; 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: 2cfu.bio1) has 23 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 2CFU; Ligand: 1DB; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 2) in the query (biounit: 2cfu.bio1) has 23 residues
No: Leader PDB Ligand Sequence Similarity
APoc FAQ
Feedback