Structure of PDB 7c9b Chain A Binding Site BS01

Receptor Information
>7c9b Chain A (length=233) Species: 8355 (Xenopus laevis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MMTMRRHLLLVSNSTLHGGGYLEHCQEHILKFLGAQVKRVLFIPYALHDR
DAYAKTARQKFEALGYGLDSVHESPDPVDAVKKAEAIFIGGGNTFRLLKA
LYDNDLIAAIRKRVLEDGVPYIGSSAGTNVATISINTTNDMPIVYPPSLK
ALELVPFNINPHYLDPGETREQRITQYHEEHDTPPVLGLREGCFLLVEGD
KATLLGITRARLFLRGKNPTEHEPGHDFSFLLG
Ligand information
Ligand IDCA
InChIInChI=1S/Ca/q+2
InChIKeyBHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Ca++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Ca+2]
FormulaCa
NameCALCIUM ION
ChEMBL
DrugBankDB14577
ZINC
PDB chain7c9b Chain A Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7c9b Crystal structure of aspartyl dipeptidase from Xenopus laevis revealed ligand binding induced loop ordering and catalytic triad assembly.
Resolution1.4 Å
Binding residue
(original residue number in PDB)		N129 T138 N139 P161
Binding residue
(residue number reindexed from 1)		N129 T138 N139 P161
Annotation score4
Enzymatic activity
Enzyme Commision number 3.4.13.21: dipeptidase E.
Gene Ontology
Molecular Function
GO:0008236 serine-type peptidase activity
GO:0016805 dipeptidase activity
Biological Process
GO:0006508 proteolysis
Cellular Component
GO:0005737 cytoplasm

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:7c9b, PDBe:7c9b, PDBj:7c9b
PDBsum7c9b
PubMed34431561
UniProtQ91642|PEPE_XENLA Alpha-aspartyl dipeptidase (Gene Name=aad-a)

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