Structure of PDB 43ca Chain G Binding Site BS01

Receptor Information
>43ca Chain G (length=113) Species: 10090 (Mus musculus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
DVVMTQTPSSLAMSVGQKVTMSCKSSQSLLNISNQKNYLAWYQQKPGQSP
KLLVYFASTRESGVPDRFIGSGSGTDFTLTISSVQAEDQADYFCQQHYRA
PRTFGGGTKLEIK
Ligand information
Ligand IDNPO
InChIInChI=1S/C6H5NO3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H
InChIKeyBTJIUGUIPKRLHP-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341Oc1ccc(cc1)[N+]([O-])=O
ACDLabs 10.04O=[N+]([O-])c1ccc(O)cc1
OpenEye OEToolkits 1.5.0c1cc(ccc1[N+](=O)[O-])O
FormulaC6 H5 N O3
NameP-NITROPHENOL
ChEMBLCHEMBL14130
DrugBankDB04417
ZINCZINC000034828682
PDB chain43ca Chain G Residue 924 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB43ca Structural basis for amide hydrolysis catalyzed by the 43C9 antibody.
Resolution2.3 Å
Binding residue
(original residue number in PDB)
Y32 L33 A34 Y49 F50 H91
Binding residue
(residue number reindexed from 1)
Y38 L39 A40 Y55 F56 H97
Annotation score1
Binding affinityMOAD: Kd<1uM
External links