Structure of PDB 7uab Chain A Binding Site BS02

Receptor Information
>7uab Chain A (length=481) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
QKDISEINLAAGLDLFQGDILLQKPNTRWTFPIPYILADNLGLNAKGAIL
YAFEMFRLKSCVDFKPYEGESSYIIFQQFDGCWSEVGDQHVGQNISIGQG
CAYKAIIEHEILHALGFYHEQSRIWWDQILSGYQHNFDTESLMHYQPFSF
NKNASVPTINSIIGQRLDFSAIDLERHTLLDHCTFEKRDDTDWAHQDSAQ
AGEVDHTYFMQFSTSSGSAEEAALLEPKRKQQCLQFFYKMTGSPSDRLVV
WVRRDDSTGNVRKLVKVQTFQGDDDHNWKIAHVVLKEEQKFRYLFQGTKG
DPQNSTGGIYLDDITLTETPCPTGVWTVRNFSQVLENTSKGDKLQSPRFY
NSEGYGFGVTLYPNSSGYLRLAFHVCSGENDAILEWPVENRQVIITILDQ
EPDVRNRMSSSMVFTTSKSHTSVIWDRPSRVGTYHTDCNCFRSIDLGWSG
FISHQMLKRRSFLKNDDLIIFVDFEDITHLS
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 chain7uab Chain A Residue 703 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7uab Helical ultrastructure of the metalloprotease meprin alpha in complex with a small molecule inhibitor.
Resolution3.7 Å
Binding residue
(original residue number in PDB)		D285 T287 D288
Binding residue
(residue number reindexed from 1)		D189 T191 D192
Annotation score4
Enzymatic activity
Enzyme Commision number 3.4.24.18: meprin A.
Gene Ontology
Molecular Function
GO:0004222 metalloendopeptidase activity
GO:0008237 metallopeptidase activity
GO:0008270 zinc ion binding
Biological Process
GO:0006508 proteolysis
Cellular Component
GO:0016020 membrane

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:7uab, PDBe:7uab, PDBj:7uab
PDBsum7uab
PubMed36261433
UniProtQ16819|MEP1A_HUMAN Meprin A subunit alpha (Gene Name=MEP1A)

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