Structure of PDB 1oar Chain L Binding Site BS01
Receptor Information
>1oar Chain L (length=108) Species:
10090
(Mus musculus) [
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AVVTQESALTTSPGETVTLTCRSSTGAVTTSNYANWVQEKPDHLFTGLIG
GTNNRAPGVPARFSGSLIGNKAALTITGAQTEDEAIYFCALWYSNHLVFG
GGTKLTVL
Ligand information
Ligand ID
AZN
InChI
InChI=1S/C14H8O7S/c15-11-6-3-1-2-4-7(6)12(16)10-8(11)5-9(22(19,20)21)13(17)14(10)18/h1-5,17-18H,(H,19,20,21)
InChIKey
JKYKXTRKURYNGW-UHFFFAOYSA-N
SMILES
Software
SMILES
CACTVS 3.341
Oc1c(O)c(cc2C(=O)c3ccccc3C(=O)c12)[S](O)(=O)=O
OpenEye OEToolkits 1.5.0
c1ccc2c(c1)C(=O)c3cc(c(c(c3C2=O)O)O)S(=O)(=O)O
ACDLabs 10.04
O=S(=O)(O)c3cc2C(=O)c1ccccc1C(=O)c2c(O)c3O
Formula
C14 H8 O7 S
Name
ALIZARIN RED
ChEMBL
CHEMBL1206015
DrugBank
ZINC
ZINC000003875857
PDB chain
1oar Chain H Residue 500 [
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Receptor-Ligand Complex Structure
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PDB
1oar
Antibody Multispecificity Mediated by Conformational Diversity
Resolution
2.23 Å
Binding residue
(original residue number in PDB)
Y34 N36 W93
Binding residue
(residue number reindexed from 1)
Y33 N35 W92
Annotation score
1
Binding affinity
PDBbind-CN
: -logKd/Ki=7.40,Kd=40nM
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Biological Process
GO:0002250
adaptive immune response
GO:0006955
immune response
Cellular Component
GO:0005615
extracellular space
GO:0019814
immunoglobulin complex
View graph for
Biological Process
View graph for
Cellular Component
External links
PDB
RCSB:1oar
,
PDBe:1oar
,
PDBj:1oar
PDBsum
1oar
PubMed
12610298
UniProt
P01724
|LV1B_MOUSE Ig lambda-1 chain V regions MOPC 104E/RPC20/J558/S104
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