Structure of PDB 2cju Chain H Binding Site BS01

Receptor Information
>2cju Chain H (length=121) Species: 10090 (Mus musculus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
EVKLVESGGGLVQPGGSLRLSCATSGFTFTNYYMNWVRQPPGKALEWLVS
IRNKANGYTTDYSASVKGRFTISRDNSQSILYLEMNNLRAEDSATYYCAR
GYGYGAWFAYWGQGTLVTVSA
Ligand information
Ligand IDPHX
InChIInChI=1S/C14H14N2O4/c17-12(18)7-4-8-15-9-11-14(19)20-13(16-11)10-5-2-1-3-6-10/h1-3,5-6,9,15H,4,7-8H2,(H,17,18)
InChIKeyPXGNVFUWTUIRCJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 12.01O=C1OC(=N\C1=C\NCCCC(=O)O)c2ccccc2
CACTVS 3.385OC(=O)CCCNC=C1N=C(OC1=O)c2ccccc2
CACTVS 3.385OC(=O)CCCN\C=C1/N=C(OC1=O)c2ccccc2
OpenEye OEToolkits 1.9.2c1ccc(cc1)C2=NC(=CNCCCC(=O)O)C(=O)O2
FormulaC14 H14 N2 O4
Name4-{[(Z)-(5-OXO-2-PHENYL-1,3-OXAZOL-4(5H)-YLIDENE)METHYL]AMINO}BUTANOIC ACID
ChEMBL
DrugBankDB08396
ZINC
PDB chain2cju Chain H Residue 1114 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB2cju Structural Basis of Affinity Maturation of the Tepc15/V(Kappa)45.1 Anti-2-Phenyl-5-Oxazolone Antibodies.
Resolution2.5 Å
Binding residue
(original residue number in PDB)		N31 Y32 Y33 G95 Y96 G97 A100 W100A
Binding residue
(residue number reindexed from 1)		N31 Y32 Y33 G101 Y102 G103 A106 W107
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0003823 antigen binding
Biological Process
GO:0002250 adaptive immune response
GO:0016064 immunoglobulin mediated immune response
Cellular Component
GO:0019814 immunoglobulin complex

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:2cju, PDBe:2cju, PDBj:2cju
PDBsum2cju
PubMed16682055
UniProtP01789|HVM20_MOUSE Ig heavy chain V region M603

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