Receptor
PDB id Resolution Class Description Source Keywords
3MMR 2.14 Å EC: 3.5.3.1 STRUCTURE OF PLASMODIUM FALCIPARUM ARGINASE IN COMPLEX WITH PLASMODIUM FALCIPARUM 3D7 MALARIA ABH LCR PARASITE L-ARGININE BORONIC ACID METALLOHYDROLASE BINUCLEAR MANGANESE HYDROLASE
Ref.: CRYSTAL STRUCTURE OF ARGINASE FROM PLASMODIUM FALCI IMPLICATIONS FOR L-ARGININE DEPLETION IN MALARIAL I . BIOCHEMISTRY V. 49 5600 2010
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ABH A:551;
Valid;
none;
Kd = 11 uM
191.998 C6 H15 B N O5 [B-](...
BME A:414;
Invalid;
none;
submit data
78.133 C2 H6 O S C(CS)...
MN A:412;
A:413;
Part of Protein;
Part of Protein;
none;
none;
submit data
54.938 Mn [Mn+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3MMR 2.14 Å EC: 3.5.3.1 STRUCTURE OF PLASMODIUM FALCIPARUM ARGINASE IN COMPLEX WITH PLASMODIUM FALCIPARUM 3D7 MALARIA ABH LCR PARASITE L-ARGININE BORONIC ACID METALLOHYDROLASE BINUCLEAR MANGANESE HYDROLASE
Ref.: CRYSTAL STRUCTURE OF ARGINASE FROM PLASMODIUM FALCI IMPLICATIONS FOR L-ARGININE DEPLETION IN MALARIAL I . BIOCHEMISTRY V. 49 5600 2010
Members (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 8 families.
1 3SL1 - FB6 C7 H16 B N O4 B(CCCCC(C)....
2 3MMR Kd = 11 uM ABH C6 H15 B N O5 [B-](CCCC[....
3 3SL0 - FB5 C7 H14 B F2 N O4 B(CCCC[C@@....
70% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 6 families.
1 3SL1 - FB6 C7 H16 B N O4 B(CCCCC(C)....
2 3MMR Kd = 11 uM ABH C6 H15 B N O5 [B-](CCCC[....
3 3SL0 - FB5 C7 H14 B F2 N O4 B(CCCC[C@@....
50% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 3SL1 - FB6 C7 H16 B N O4 B(CCCCC(C)....
2 3MMR Kd = 11 uM ABH C6 H15 B N O5 [B-](CCCC[....
3 3SL0 - FB5 C7 H14 B F2 N O4 B(CCCC[C@@....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: ABH; Similar ligands found: 8
No: Ligand ECFP6 Tc MDL keys Tc
1 ABH 1 1
2 DHH 0.527778 0.666667
3 NPI 0.513514 0.625
4 6HN 0.475 0.62
5 11C 0.459459 0.6
6 UN1 0.459459 0.6
7 2JJ 0.435897 0.853659
8 5OY 0.435897 0.853659
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3MMR; Ligand: ABH; 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: 3mmr.bio2) has 18 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 3MMR; Ligand: ABH; 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: 3mmr.bio2) has 18 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 3MMR; Ligand: ABH; 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: 3mmr.bio2) has 18 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 3MMR; Ligand: ABH; 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: 3mmr.bio2) has 18 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 5; Query (leader) PDB : 3MMR; Ligand: ABH; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 5) in the query (biounit: 3mmr.bio2) has 18 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 6; Query (leader) PDB : 3MMR; Ligand: ABH; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 6) in the query (biounit: 3mmr.bio2) has 18 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 7; Query (leader) PDB : 3MMR; Ligand: ABH; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 7) in the query (biounit: 3mmr.bio1) has 18 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 8; Query (leader) PDB : 3MMR; Ligand: ABH; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 8) in the query (biounit: 3mmr.bio1) has 18 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 9; Query (leader) PDB : 3MMR; Ligand: ABH; Similar sites found with APoc: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 9) in the query (biounit: 3mmr.bio1) has 18 residues
No: Leader PDB Ligand Sequence Similarity
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