Receptor
PDB id Resolution Class Description Source Keywords
1Z6K 2.3 Å EC: 4.1.3.6 CITRATE LYASE BETA SUBUNIT COMPLEXED WITH OXALOACETATE AND M FROM M. TUBERCULOSIS MYCOBACTERIUM TUBERCULOSIS TIM BARREL STRUCTURAL GENOMICS PSI PROTEIN STRUCTURE INITTB STRUCTURAL GENOMICS CONSORTIUM TBSGC LYASE
Ref.: THE STRUCTURE AND COMPUTATIONAL ANALYSIS OF MYCOBAC TUBERCULOSIS PROTEIN CITE SUGGEST A NOVEL ENZYMATIC FUNCTION. J.MOL.BIOL. V. 365 275 2007
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
MG A:275;
Part of Protein;
none;
submit data
24.305 Mg [Mg+2...
OAA A:274;
Valid;
none;
submit data
131.064 C4 H3 O5 C(C(=...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1Z6K 2.3 Å EC: 4.1.3.6 CITRATE LYASE BETA SUBUNIT COMPLEXED WITH OXALOACETATE AND M FROM M. TUBERCULOSIS MYCOBACTERIUM TUBERCULOSIS TIM BARREL STRUCTURAL GENOMICS PSI PROTEIN STRUCTURE INITTB STRUCTURAL GENOMICS CONSORTIUM TBSGC LYASE
Ref.: THE STRUCTURE AND COMPUTATIONAL ANALYSIS OF MYCOBAC TUBERCULOSIS PROTEIN CITE SUGGEST A NOVEL ENZYMATIC FUNCTION. J.MOL.BIOL. V. 365 275 2007
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1Z6K - OAA C4 H3 O5 C(C(=O)C(=....
70% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 1Z6K - OAA C4 H3 O5 C(C(=O)C(=....
2 1U5V - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
50% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 1Z6K - OAA C4 H3 O5 C(C(=O)C(=....
2 1U5V - ATP C10 H16 N5 O13 P3 c1nc(c2c(n....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: OAA; Similar ligands found: 4
No: Ligand ECFP6 Tc MDL keys Tc
1 OAA 1 1
2 MLI 0.5 0.666667
3 3PY 0.428571 0.681818
4 2KT 0.409091 0.684211
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1Z6K; Ligand: OAA; 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: 1z6k.bio1) has 11 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 1Z6K; Ligand: OAA; 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: 1z6k.bio1) has 11 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 1Z6K; Ligand: OAA; 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: 1z6k.bio1) has 11 residues
No: Leader PDB Ligand Sequence Similarity
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