Receptor
PDB id Resolution Class Description Source Keywords
5T96 2 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF THE INFECTIOUS SALMON ANEMIA VIRUS (ISA VIRAL RECEPTOR COMPLEX INFECTIOUS SALMON ANEMIA VIRUS 4-0-ACETYLSIALIC ACID HYDROLASE HEMAGGLUTININ COILED-COILRECEPTOR-COMPLEX INFECTIOUS SALMON ANEMIA VIRUS ISAV VIRPROTEIN
Ref.: STRUCTURE OF THE INFECTIOUS SALMON ANEMIA VIRUS REC COMPLEX ILLUSTRATES A UNIQUE BINDING STRATEGY FOR ATTACHMENT. PROC. NATL. ACAD. SCI. V. 114 E2929 2017 U.S.A.
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
MG D:401;
A:402;
F:401;
A:401;
D:402;
B:401;
Part of Protein;
Invalid;
Invalid;
Part of Protein;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
submit data
24.305 Mg [Mg+2...
FMT C:401;
C:408;
F:404;
B:407;
F:405;
D:408;
B:408;
A:408;
B:410;
A:405;
C:404;
D:406;
C:406;
C:405;
E:404;
B:405;
F:406;
D:407;
D:412;
A:407;
A:406;
D:410;
C:407;
E:403;
D:411;
B:409;
D:409;
B:406;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
46.025 C H2 O2 C(=O)...
79J C:402;
B:402;
E:401;
F:402;
A:403;
D:403;
Valid;
Valid;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
none;
none;
submit data
351.307 C13 H21 N O10 CC(=O...
GOL B:404;
C:403;
E:402;
A:404;
B:403;
F:403;
D:405;
D:404;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
92.094 C3 H8 O3 C(C(C...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5T96 2 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF THE INFECTIOUS SALMON ANEMIA VIRUS (ISA VIRAL RECEPTOR COMPLEX INFECTIOUS SALMON ANEMIA VIRUS 4-0-ACETYLSIALIC ACID HYDROLASE HEMAGGLUTININ COILED-COILRECEPTOR-COMPLEX INFECTIOUS SALMON ANEMIA VIRUS ISAV VIRPROTEIN
Ref.: STRUCTURE OF THE INFECTIOUS SALMON ANEMIA VIRUS REC COMPLEX ILLUSTRATES A UNIQUE BINDING STRATEGY FOR ATTACHMENT. PROC. NATL. ACAD. SCI. V. 114 E2929 2017 U.S.A.
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1579 families.
1 5T96 - 79J C13 H21 N O10 CC(=O)N[C@....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1312 families.
1 5T96 - 79J C13 H21 N O10 CC(=O)N[C@....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1130 families.
1 5T96 - 79J C13 H21 N O10 CC(=O)N[C@....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: 79J; Similar ligands found: 17
No: Ligand ECFP6 Tc MDL keys Tc
1 79J 1 1
2 SIA 0.615385 0.934783
3 SLB 0.615385 0.934783
4 SIO 0.519481 0.918367
5 42D 0.513889 0.86
6 18D 0.493151 0.895833
7 NGE 0.486111 0.875
8 NGC 0.486111 0.875
9 MNA 0.479452 0.918367
10 6KL 0.472973 0.865385
11 CNP 0.467532 0.823529
12 FSI 0.465753 0.843137
13 SFJ 0.452055 0.823529
14 KDM 0.42029 0.673913
15 KDN 0.42029 0.673913
16 SIA SIA 0.4 0.849057
17 SLB SIA 0.4 0.849057
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 5T96; Ligand: 79J; 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: 5t96.bio2) has 10 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 2; Query (leader) PDB : 5T96; Ligand: 79J; 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: 5t96.bio2) has 11 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 3; Query (leader) PDB : 5T96; Ligand: 79J; 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: 5t96.bio2) has 10 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 4; Query (leader) PDB : 5T96; Ligand: 79J; 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: 5t96.bio1) has 12 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 5; Query (leader) PDB : 5T96; Ligand: 79J; 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: 5t96.bio1) has 10 residues
No: Leader PDB Ligand Sequence Similarity
Pocket No.: 6; Query (leader) PDB : 5T96; Ligand: 79J; 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: 5t96.bio1) has 10 residues
No: Leader PDB Ligand Sequence Similarity
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