Structure of PDB 8slv Chain A Binding Site BS03

Receptor Information
>8slv Chain A (length=562) Species: 7159 (Aedes aegypti) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GLDWWEHGNFYQVYPRSFKDSDGDGIGDLDGVTEKLKYLKDIGMDGVWLS
PIFSSPMADFGYDISNFREIQTEYGDLDAFQRLSDKCKQLGLHLILDFVP
NHTSDQHEYFKKSVQKDETYKDFYVWHPGVHGPNNTKVPPSNWISVFRGS
SWEWNEERQEFYLHQFLKEQPDLNYRNPAVVEEMKNVLRYWLDRGVSGFR
IDAVPYLFESDIIDGRYRNEPESRTTDDPENPAYLVHTQTMDQPETYDMI
YQWRAVLDEYSKTDNRTRIMMTEGYTSLPKIIEFFGNATANGAQIPFNFE
VISNVKKNSTGADFATYVKRWLDAKPANRRSNWVLGNHDNNRLGSRLGEN
KIDLYNIALQTLPDIAVTYYGEEIGMLDQWIPWNETVDPAACRSDEASYS
AYSRDPARTPMQWDSGKNAGFSKAAKTWLPVADNYKTLNVKIQDRARKSH
LKIFKKLTKYRKRQILTEGDIDIKVSGENLLVYKRKVDKVGYVVVALNFG
TEPVALGLSSLFDRADQRMQVVVSSNRVSTPDNVWVDVDNYVLIGESGIV
LQYLWGKNPIVS
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 chain8slv Chain A Residue 611 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB8slv Structural and functional comparisons of salivary alpha-glucosidases from the mosquito vectors Aedes aegypti, Anopheles gambiae, and Culex quinquefasciatus.
Resolution2.32 Å
Binding residue
(original residue number in PDB)		D37 D39 D41 I43 D45
Binding residue
(residue number reindexed from 1)		D20 D22 D24 I26 D28
Annotation score4
Enzymatic activity
Enzyme Commision number 3.2.1.20: alpha-glucosidase.
Gene Ontology
Biological Process
GO:0005975 carbohydrate metabolic process

View graph for
Biological Process
External links
PDB RCSB:8slv, PDBe:8slv, PDBj:8slv
PDBsum8slv
PubMed38428508
UniProtP13080|MALT_AEDAE Probable maltase (Gene Name=MAL1)

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