Structure of PDB 1oau Chain J Binding Site BS01
Receptor Information
>1oau Chain J (length=122) Species:
10090
(Mus musculus) [
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EVQLQQSGAELVKPGASVKLSCKASGYTFTSYWMHWVKQRPGRGLEWIGR
IDPNGGGTKYNEKFKSKATLTVDKPSSTAYMQLSSLTSEDSAVYYCARMW
YYGTYYFDYWGQGTTLTVSSAA
Ligand information
Ligand ID
DNF
InChI
InChI=1S/C6H4N2O5/c9-6-2-1-4(7(10)11)3-5(6)8(12)13/h1-3,9H
InChIKey
UFBJCMHMOXMLKC-UHFFFAOYSA-N
SMILES
Software
SMILES
CACTVS 3.341
Oc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O
OpenEye OEToolkits 1.5.0
c1cc(c(cc1[N+](=O)[O-])[N+](=O)[O-])O
ACDLabs 10.04
O=[N+]([O-])c1cc(ccc1O)[N+]([O-])=O
Formula
C6 H4 N2 O5
Name
2,4-DINITROPHENOL
ChEMBL
CHEMBL273386
DrugBank
DB04528
ZINC
ZINC000012358776
PDB chain
1oau Chain J Residue 501 [
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Receptor-Ligand Complex Structure
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PDB
1oau
Antibody Multispecificity Mediated by Conformational Diversity
Resolution
1.8 Å
Binding residue
(original residue number in PDB)
W33 R50 M99 Y105
Binding residue
(residue number reindexed from 1)
W33 R50 M99 Y105
Annotation score
1
External links
PDB
RCSB:1oau
,
PDBe:1oau
,
PDBj:1oau
PDBsum
1oau
PubMed
12610298
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