Receptor
PDB id Resolution Class Description Source Keywords
1OIJ 2.1 Å EC: 1.-.-.- CRYSTAL STRUCTURE OF THE ALKYLSULFATASE ATSK, A NON-HEME FE( ALPHAKETOGLUTARATE DEPENDENT DIOXYGENASE IN COMPLEX WITH A LPHAKETOGLUTARATE PSEUDOMONAS PUTIDA OXIDOREDUCTASE JELLY ROLL
Ref.: CRYSTAL STRUCTURE OF THE ALKYLSULFATASE ATSK: INSIG THE CATALYTIC MECHANISM OF THE FE(II) ALPHA-KETOGLUTARATE-DEPENDENT DIOXYGENASE SUPERFAMI BIOCHEMISTRY V. 42 3075 2004
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
AKG A:1302;
B:1302;
C:1301;
D:1301;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
submit data
146.098 C5 H6 O5 C(CC(...
NA A:1301;
B:1301;
C:1300;
D:1300;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
none;
none;
none;
none;
submit data
22.99 Na [Na+]
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1OIJ 2.1 Å EC: 1.-.-.- CRYSTAL STRUCTURE OF THE ALKYLSULFATASE ATSK, A NON-HEME FE( ALPHAKETOGLUTARATE DEPENDENT DIOXYGENASE IN COMPLEX WITH A LPHAKETOGLUTARATE PSEUDOMONAS PUTIDA OXIDOREDUCTASE JELLY ROLL
Ref.: CRYSTAL STRUCTURE OF THE ALKYLSULFATASE ATSK: INSIG THE CATALYTIC MECHANISM OF THE FE(II) ALPHA-KETOGLUTARATE-DEPENDENT DIOXYGENASE SUPERFAMI BIOCHEMISTRY V. 42 3075 2004
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 352 families.
1 1OIJ - AKG C5 H6 O5 C(CC(=O)O)....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 311 families.
1 1OIJ - AKG C5 H6 O5 C(CC(=O)O)....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 207 families.
1 1OIJ - AKG C5 H6 O5 C(CC(=O)O)....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: AKG; Similar ligands found: 7
No: Ligand ECFP6 Tc MDL keys Tc
1 AKG 1 1
2 SIN 0.526316 0.833333
3 OOG 0.5 0.947368
4 69O 0.458333 0.714286
5 2IT 0.423077 0.615385
6 SHF 0.416667 0.666667
7 3PY 0.409091 0.652174
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1OIJ; Ligand: AKG; 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: 1oij.bio2) has 11 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 1OIJ; Ligand: AKG; 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: 1oij.bio1) has 11 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 1OIJ; Ligand: AKG; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 3) in the query (biounit: 1oij.bio3) has 11 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 1OIJ; Ligand: AKG; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 4) in the query (biounit: 1oij.bio4) has 10 residues
No: Leader PDB Ligand Sequence Similarity
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