Receptor
PDB id Resolution Class Description Source Keywords
1OAR 2.22 Å NON-ENZYME: IMMUNE FV IGE SPE-7 IN COMPLEX WITH ALIZARIN RED MUS MUSCULUS IMMUNE SYSTEM ANTIBODY-COMPLEX ANTIBODY ALLERGY IGE CONFORMATIONAL DIVERSITY MULTISPECIFICITY
Ref.: ANTIBODY MULTISPECIFICITY MEDIATED BY CONFORMATIONA DIVERSITY SCIENCE V. 299 1362 2003
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
AZN H:500;
I:500;
J:500;
K:500;
Valid;
Valid;
Valid;
Valid;
none;
none;
none;
none;
Kd = 40 nM
320.274 C14 H8 O7 S c1ccc...
CAC H:201;
J:201;
Invalid;
Invalid;
none;
none;
submit data
136.989 C2 H6 As O2 C[As]...
CL L:911;
L:912;
L:913;
M:913;
N:911;
N:912;
N:913;
O:913;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
35.453 Cl [Cl-]
DMS H:300;
H:301;
H:302;
H:303;
H:304;
H:305;
H:306;
J:300;
J:301;
J:302;
J:303;
J:304;
J:305;
J:306;
L:300;
L:301;
L:302;
L:303;
L:304;
N:300;
N:301;
N:302;
N:303;
N:304;
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;
submit data
78.133 C2 H6 O S CS(=O...
EDO H:401;
J:401;
Invalid;
Invalid;
none;
none;
submit data
62.068 C2 H6 O2 C(CO)...
NA H:903;
I:903;
J:903;
L:901;
M:903;
N:901;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
Part of Protein;
none;
none;
none;
none;
none;
none;
submit data
22.99 Na [Na+]
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
1OAU 1.8 Å NON-ENZYME: IMMUNE FV STRUCTURE OF THE IGE SPE-7 IN COMPLEX WITH DNP-SER (IMMUNISING HAPTEN) MUS MUSCULUS IMMUNE SYSTEM ANTIBODY/COMPLEX ANTIBODY ALLERGY IGE CONFORMATIONAL DIVERSITY MULTISPECIFICITY
Ref.: ANTIBODY MULTISPECIFICITY MEDIATED BY CONFORMATIONAL DIVERSITY SCIENCE V. 299 1362 2003
Members (5)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 199 families.
1 1OAR Kd = 40 nM AZN C14 H8 O7 S c1ccc2c(c1....
2 2BJM Ka < 100000 M^-1 ANF C14 H10 O c1ccc2c(c1....
3 1A6V - NPC C14 H17 N2 O6 c1cc(c(cc1....
4 1OAU Kd = 20 nM DNF SER n/a n/a
5 1A6W - NIP C14 H16 I N2 O6 c1c(cc(c(c....
70% Homology Family (6)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 65 families.
1 1MFA Kd = 9.1 uM GLA MMA ABE n/a n/a
2 1OAR Kd = 40 nM AZN C14 H8 O7 S c1ccc2c(c1....
3 2BJM Ka < 100000 M^-1 ANF C14 H10 O c1ccc2c(c1....
4 1A6V - NPC C14 H17 N2 O6 c1cc(c(cc1....
5 1OAU Kd = 20 nM DNF SER n/a n/a
6 1A6W - NIP C14 H16 I N2 O6 c1c(cc(c(c....
50% Homology Family (15)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 43 families.
1 2BFV - STG C24 H32 O9 C[C@]12CC[....
2 1BFV Ka ~ 10000000 M^-1 STG C24 H32 O9 C[C@]12CC[....
3 1CFV Ka ~ 100000000 M^-1 E3G C24 H30 O8 C[C@]12CC[....
4 2CJU - PHX C14 H14 N2 O4 c1ccc(cc1)....
5 1WZ1 - DNS C18 H25 N3 O4 S CN(C)c1ccc....
6 43CA Kd < 1 uM NPO C6 H5 N O3 c1cc(ccc1[....
7 3DUS - KDO C8 H14 O8 C1[C@H]([C....
8 3DUR - KDO C8 H14 O8 C1[C@H]([C....
9 3DV6 - KDO C8 H14 O8 C1[C@H]([C....
10 1DL7 Kd = 0.32 uM NCH C11 H18 N2 O6 P C[N+](C)(C....
11 2E27 Ka = 2220000000 M^-1 AB0 C16 H24 O8 COCO[C@H]1....
12 1OAR Kd = 40 nM AZN C14 H8 O7 S c1ccc2c(c1....
13 2BJM Ka < 100000 M^-1 ANF C14 H10 O c1ccc2c(c1....
14 1A6V - NPC C14 H17 N2 O6 c1cc(c(cc1....
15 3T0X - DIW C26 H29 N2 O3 S CC1(c2cccc....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: AZN; Similar ligands found: 1
No: Ligand ECFP6 Tc MDL keys Tc
1 AZN 1 1
Similar Binding Sites (Proteins are less than 50% similar to leader)
Feedback