Receptor
PDB id Resolution Class Description Source Keywords
3LTW 2.1 Å EC: 2.3.1.5 THE STRUCTURE OF MYCOBACTERIUM MARINUM ARYLAMINE N-ACETYLTRA IN COMPLEX WITH HYDRALAZINE MYCOBACTERIUM MARINUM MYCOBACTERIUM MARINUM ARYALMINE N-ACETYL TRANSFERASE MMNATHYDRALAZINE MYCOBACTERIUM TUBERCULOSIS TRANSFERASE
Ref.: PROBING THE ARCHITECTURE OF THE MYCOBACTERIUM MARIN ARYLAMINE N-ACETYLTRANSFERASE ACTIVE SITE PROTEIN CELL V. 1 384 2010
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
FMT A:281;
A:282;
A:999;
Invalid;
Invalid;
Invalid;
none;
none;
none;
submit data
46.025 C H2 O2 C(=O)...
HLZ A:300;
A:302;
Valid;
Valid;
none;
none;
submit data
160.176 C8 H8 N4 c1ccc...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3LTW 2.1 Å EC: 2.3.1.5 THE STRUCTURE OF MYCOBACTERIUM MARINUM ARYLAMINE N-ACETYLTRA IN COMPLEX WITH HYDRALAZINE MYCOBACTERIUM MARINUM MYCOBACTERIUM MARINUM ARYALMINE N-ACETYL TRANSFERASE MMNATHYDRALAZINE MYCOBACTERIUM TUBERCULOSIS TRANSFERASE
Ref.: PROBING THE ARCHITECTURE OF THE MYCOBACTERIUM MARIN ARYLAMINE N-ACETYLTRANSFERASE ACTIVE SITE PROTEIN CELL V. 1 384 2010
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 3 families.
1 3LTW - HLZ C8 H8 N4 c1ccc2c(c1....
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 3LTW - HLZ C8 H8 N4 c1ccc2c(c1....
2 1W6F - ISZ C6 H5 N3 O [H]/N=N/C(....
50% Homology Family (3)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 4NV7 - COA C21 H36 N7 O16 P3 S CC(C)(CO[P....
2 3LTW - HLZ C8 H8 N4 c1ccc2c(c1....
3 1W6F - ISZ C6 H5 N3 O [H]/N=N/C(....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: HLZ; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 HLZ 1 1
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3LTW; Ligand: HLZ; 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: 3ltw.bio1) has 11 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 3LTW; Ligand: HLZ; 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: 3ltw.bio1) has 12 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 3LTW; Ligand: HLZ; 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: 3ltw.bio2) has 11 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 3LTW; Ligand: HLZ; 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: 3ltw.bio2) has 11 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 5; Query (leader) PDB : 3LTW; Ligand: HLZ; 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: 3ltw.bio2) has 12 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 6; Query (leader) PDB : 3LTW; Ligand: HLZ; 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: 3ltw.bio2) has 12 residues
No: Leader PDB Ligand Sequence Similarity
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