Receptor
PDB id Resolution Class Description Source Keywords
5MUL 1.39 Å EC: 7.-.-.- GLYCOSIDE HYDROLASE BT3686 BOUND TO GLUCURONIC ACID BACTEROIDES THETAIOTAOMICRON (STRAIN A/ DSM 2079 / NCTC 10582 / E50 / VPI-5482) RHAMNOSIDASE BACTEROIDES BETA-PROPELLER HYDROLASE
Ref.: UNUSUAL ACTIVE SITE LOCATION AND CATALYTIC APPARATU GLYCOSIDE HYDROLASE FAMILY. PROC. NATL. ACAD. SCI. V. 114 4936 2017 U.S.A.
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
BDP A:501;
Valid;
none;
submit data
194.139 C6 H10 O7 [C@@H...
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90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5MUL 1.39 Å EC: 7.-.-.- GLYCOSIDE HYDROLASE BT3686 BOUND TO GLUCURONIC ACID BACTEROIDES THETAIOTAOMICRON (STRAIN A/ DSM 2079 / NCTC 10582 / E50 / VPI-5482) RHAMNOSIDASE BACTEROIDES BETA-PROPELLER HYDROLASE
Ref.: UNUSUAL ACTIVE SITE LOCATION AND CATALYTIC APPARATU GLYCOSIDE HYDROLASE FAMILY. PROC. NATL. ACAD. SCI. V. 114 4936 2017 U.S.A.
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 293 families.
1 5MUL - BDP C6 H10 O7 [C@@H]1([C....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 250 families.
1 5MUL - BDP C6 H10 O7 [C@@H]1([C....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 204 families.
1 5MUL - BDP C6 H10 O7 [C@@H]1([C....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: BDP; Similar ligands found: 8
No: Ligand ECFP6 Tc MDL keys Tc
1 ADA 1 1
2 GCU 1 1
3 BDP 1 1
4 GTR 1 1
5 AD0 0.458333 0.821429
6 GCV 0.45 0.884615
7 GCW 0.45 0.884615
8 TGU 0.423077 0.821429
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 5MUL; Ligand: BDP; 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: 5mul.bio1) has 13 residues
No: Leader PDB Ligand Sequence Similarity
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