Receptor
PDB id Resolution Class Description Source Keywords
4C4N 2.36 Å NON-ENZYME: SIGNAL_HORMONE CRYSTAL STRUCTURE OF THE SONIC HEDGEHOG-HEPARIN COMPLEX MUS MUSCULUS SIGNALING PROTEIN HEDGEHOG SIGNALLING MORPHOGENS HEPARAN PROTEOGLYCANS GLYCOSAMINOGLYCANS
Ref.: STRUCTURAL INSIGHTS INTO PROTEOGLYCAN-SHAPED HEDGEH SIGNALING. PROC.NATL.ACAD.SCI.USA V. 110 16420 2013
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CL B:1195;
 Invalid;
 none;
 submit data
35.453 Cl [Cl-]
CA B:1193;
A:1192;
B:1194;
A:1193;
 Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
 none;
none;
none;
none;
 submit data
40.078 Ca [Ca+2...
ZN B:1192;
A:1191;
 Part of Protein;
Part of Protein;
 none;
none;
 submit data
65.409 Zn [Zn+2...
IDS SGN IDS SGN IDS SGN C:1;
 Valid;
 none;
 submit data
1722.33 n/a S(=O)...
SGN IDS SGN IDS SGN IDS D:1;
 Valid;
 none;
 submit data
n/a n/a
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
4C4M 1.74 Å NON-ENZYME: SIGNAL_HORMONE CRYSTAL STRUCTURE OF THE SONIC HEDGEHOG-CHONDROITIN-4-SULPHA MUS MUSCULUS SIGNALING PROTEIN HEDGEHOG SIGNALLING MORPHOGENS HEPARAN PROTEOGLYCANS GLYCOSAMINOGLYCANS
Ref.: STRUCTURAL INSIGHTS INTO PROTEOGLYCAN-SHAPED HEDGEH SIGNALING. PROC.NATL.ACAD.SCI.USA V. 110 16420 2013
Members (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 289 families.
1 4C4M - ASG BDP ASG BDP n/a n/a
2 4C4N - IDS SGN IDS SGN IDS SGN n/a n/a
70% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 214 families.
1 4C4M - ASG BDP ASG BDP n/a n/a
2 4C4N - IDS SGN IDS SGN IDS SGN n/a n/a
50% Homology Family (2)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 181 families.
1 4C4M - ASG BDP ASG BDP n/a n/a
2 4C4N - IDS SGN IDS SGN IDS SGN n/a n/a
Polypharmacology
Similar Ligands (2D)
Ligand no: 1; Ligand: IDS SGN IDS SGN IDS SGN; Similar ligands found: 14
No: Ligand ECFP6 Tc MDL keys Tc
1 IDS SGN IDS SGN IDS SGN 1 1
2 SGN IDS SGN IDS SGN 0.852941 1
3 IDS SGN IDS SGN IDS 0.733945 0.984375
4 IDS SGN IDS SGN IDS SUS IDS SGN 0.684211 0.984375
5 SGN IDS SGN IDS 0.636364 0.96875
6 SGN IDS SGN IDS SGN UAP 0.578512 0.939394
7 SGN IDS SGN UAP 0.578512 0.939394
8 ZDO IDS SUS BDP SGN 0.539062 0.954545
9 IDS SGN IDS SGN UAP 0.526718 0.939394
10 IDY SGN 0.518182 0.939394
11 IDY SUS 0.482143 0.909091
12 SGN IDU 0.439655 0.96875
13 IDY GNX 0.4375 0.895522
14 BDP NPO GNS IDS GNS BDP GNS 0.411348 0.84
Ligand no: 2; Ligand: SGN IDS SGN IDS SGN IDS; Similar ligands found: 0
No: Ligand ECFP6 Tc MDL keys Tc
Similar Ligands (3D)
Ligand no: 1; Ligand: IDS SGN IDS SGN IDS SGN; Similar ligands found: 0
No: Ligand Similarity coefficient
Ligand no: 2; Ligand: SGN IDS SGN IDS SGN IDS; Similar ligands found: 1
No: Ligand Similarity coefficient
1 SGN IDS SGN IDS SGN IDS 1.0000
Similar Binding Sites (Proteins are less than 50% similar to leader) APoc FAQ
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