Receptor
PDB id Resolution Class Description Source Keywords
1ZUI 2.3 Å EC: 2.7.1.71 STRUCTURAL BASIS FOR SHIKIMATE-BINDING SPECIFICITY OF HELICO PYLORI SHIKIMATE KINASE HELICOBACTER PYLORI ALPHA-BETA PROTEIN TRANSFERASE
Ref.: STRUCTURAL BASIS FOR SHIKIMATE-BINDING SPECIFICITY HELICOBACTER PYLORI SHIKIMATE KINASE J.BACTERIOL. V. 187 8156 2005
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
PO4 A:1001;
Invalid;
none;
submit data
94.971 O4 P [O-]P...
SKM A:2001;
Valid;
none;
submit data
174.151 C7 H10 O5 C1[C@...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1ZUI 2.3 Å EC: 2.7.1.71 STRUCTURAL BASIS FOR SHIKIMATE-BINDING SPECIFICITY OF HELICO PYLORI SHIKIMATE KINASE HELICOBACTER PYLORI ALPHA-BETA PROTEIN TRANSFERASE
Ref.: STRUCTURAL BASIS FOR SHIKIMATE-BINDING SPECIFICITY HELICOBACTER PYLORI SHIKIMATE KINASE J.BACTERIOL. V. 187 8156 2005
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1ZUI - SKM C7 H10 O5 C1[C@H]([C....
2 3MUF - S3P C7 H11 O8 P C1[C@H]([C....
70% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1ZUI - SKM C7 H10 O5 C1[C@H]([C....
2 3MUF - S3P C7 H11 O8 P C1[C@H]([C....
50% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 2 families.
1 1ZUI - SKM C7 H10 O5 C1[C@H]([C....
2 3MUF - S3P C7 H11 O8 P C1[C@H]([C....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: SKM; Similar ligands found: 2
No: Ligand ECFP6 Tc MDL keys Tc
1 SKM 1 1
2 S3P 0.456522 0.641026
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1ZUI; Ligand: SKM; 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: 1zui.bio1) has 36 residues
No: Leader PDB Ligand Sequence Similarity
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