Receptor
PDB id Resolution Class Description Source Keywords
1B4N 2.4 Å EC: 1.-.-.- FORMALDEHYDE FERREDOXIN OXIDOREDUCTASE FROM PYROCOCCUS FURIO COMPLEXED WITH GLUTARATE PYROCOCCUS FURIOSUS OXIDOREDUCTASE TUNGSTOENZYME MOCO TUNGSTEN CONTAINING PROHYPERTHERMOPHILE
Ref.: FORMALDEHYDE FERREDOXIN OXIDOREDUCTASE FROM PYROCOC FURIOSUS: THE 1.85 A RESOLUTION CRYSTAL STRUCTURE A MECHANISTIC IMPLICATIONS. J.MOL.BIOL. V. 286 899 1999
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CA A:620;
B:620;
C:620;
D:620;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
none;
none;
none;
none;
submit data
40.078 Ca [Ca+2...
GUA A:622;
B:622;
C:622;
D:622;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
submit data
132.115 C5 H8 O4 C(CC(...
PTE A:623;
B:623;
C:623;
D:623;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
none;
none;
none;
none;
submit data
1031.85 C20 H29 Mg N10 O14 P2 S4 W C([C@...
SF4 A:621;
B:621;
C:621;
D:621;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
none;
none;
none;
none;
submit data
351.64 Fe4 S4 [S]12...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1B4N 2.4 Å EC: 1.-.-.- FORMALDEHYDE FERREDOXIN OXIDOREDUCTASE FROM PYROCOCCUS FURIO COMPLEXED WITH GLUTARATE PYROCOCCUS FURIOSUS OXIDOREDUCTASE TUNGSTOENZYME MOCO TUNGSTEN CONTAINING PROHYPERTHERMOPHILE
Ref.: FORMALDEHYDE FERREDOXIN OXIDOREDUCTASE FROM PYROCOC FURIOSUS: THE 1.85 A RESOLUTION CRYSTAL STRUCTURE A MECHANISTIC IMPLICATIONS. J.MOL.BIOL. V. 286 899 1999
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 352 families.
1 1B4N - GUA C5 H8 O4 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 1B4N - GUA C5 H8 O4 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 1B4N - GUA C5 H8 O4 C(CC(=O)O)....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: GUA; Similar ligands found: 12
No: Ligand ECFP6 Tc MDL keys Tc
1 GUA 1 1
2 0L1 0.647059 0.944444
3 OOG 0.590909 0.894737
4 PML 0.578947 0.894737
5 SIN 0.5625 0.882353
6 LEA 0.55 0.619048
7 AZ1 0.55 0.85
8 SHO 0.5 0.714286
9 SHF 0.428571 0.619048
10 12H 0.423077 0.652174
11 MLA 0.411765 0.65
12 SSN 0.409091 0.764706
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1B4N; Ligand: GUA; 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: 1b4n.bio1) has 12 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 1B4N; Ligand: GUA; 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: 1b4n.bio1) has 12 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 1B4N; Ligand: GUA; 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: 1b4n.bio1) has 12 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 1B4N; Ligand: GUA; 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: 1b4n.bio1) has 12 residues
No: Leader PDB Ligand Sequence Similarity
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