Receptor
PDB id Resolution Class Description Source Keywords
1GMN 2.3 Å NON-ENZYME: SIGNAL_HORMONE CRYSTAL STRUCTURES OF NK1-HEPARIN COMPLEXES REVEAL THE BASIS ACTIVITY AND ENABLE ENGINEERING OF POTENT AGONISTS OF THE MR ECEPTOR HOMO SAPIENS HGF/SF HORMONE/GROWTH FACTOR HORMONE-GROWTH FACTOR COMPLEX
Ref.: CRYSTAL STRUCTURES OF NK1-HEPARIN COMPLEXES REVEAL FOR NK1 ACTIVITY AND ENABLE ENGINEERING OF POTENT A OF THE MET RECEPTOR EMBO J. V. 20 5543 2001
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
EPE A:306;
B:301;
Invalid;
Invalid;
none;
none;
submit data
238.305 C8 H18 N2 O4 S C1CN(...
IDS SGN IDS SGN IDS C:1;
Valid;
none;
submit data
1403.06 n/a S(=O)...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1GMN 2.3 Å NON-ENZYME: SIGNAL_HORMONE CRYSTAL STRUCTURES OF NK1-HEPARIN COMPLEXES REVEAL THE BASIS ACTIVITY AND ENABLE ENGINEERING OF POTENT AGONISTS OF THE MR ECEPTOR HOMO SAPIENS HGF/SF HORMONE/GROWTH FACTOR HORMONE-GROWTH FACTOR COMPLEX
Ref.: CRYSTAL STRUCTURES OF NK1-HEPARIN COMPLEXES REVEAL FOR NK1 ACTIVITY AND ENABLE ENGINEERING OF POTENT A OF THE MET RECEPTOR EMBO J. V. 20 5543 2001
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 289 families.
1 1GMN - IDS SGN IDS SGN IDS n/a n/a
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 214 families.
1 1GMN - IDS SGN IDS SGN IDS n/a n/a
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 181 families.
1 1GMN - IDS SGN IDS SGN IDS n/a n/a
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: IDS SGN IDS SGN IDS; Similar ligands found: 14
No: Ligand ECFP6 Tc MDL keys Tc
1 IDS SGN IDS SGN IDS 1 1
2 IDS SGN IDS SGN IDS SGN 0.733945 0.984375
3 IDS SGN IDS SGN IDS SUS IDS SGN 0.675439 0.96875
4 SGN IDU 0.627451 0.984127
5 SGN IDS SGN IDS 0.627273 0.984127
6 SGN IDS SGN IDS SGN 0.62069 0.984375
7 SGN IDS SGN IDS SGN UAP 0.583333 0.953846
8 SGN IDS SGN UAP 0.583333 0.953846
9 IDS SGN IDS SGN UAP 0.542636 0.924242
10 ZDO IDS SUS BDP SGN 0.51938 0.939394
11 IDY SGN 0.509091 0.924242
12 IDY SUS 0.486486 0.893939
13 IDY GNX 0.415929 0.880597
14 BDP NPO GNS IDS GNS BDP GNS 0.414286 0.826667
Similar Ligands (3D)
Ligand no: 1; Ligand: IDS SGN IDS SGN IDS; Similar ligands found: 0
No: Ligand Similarity coefficient
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 1GMN; Ligand: IDS SGN IDS SGN IDS; 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: 1gmn.bio1) has 12 residues
No: Leader PDB Ligand Sequence Similarity
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