Structure of PDB 7z1i Chain B Binding Site BS01

Receptor Information
>7z1i Chain B (length=493) Species: 3702 (Arabidopsis thaliana) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
EFVCEENEPFTCNQTKLFNSGNFEKGFIFGVASSAYQVEGGRGRGLNVWD
SFTHRFPEKGGADLGNGDTTCDSYTLWQKDIDVMDELNSTGYRFSIAWSR
LLPKGKRSRGVNPGAIKYYNGLIDGLVAKNMTPFVTLFHWDLPQTLQDEY
NGFLNKTIVDDFKDYADLCFELFGDRVKNWITINQLYTVPTRGYALGTDA
PGRCSPKIDVRCPGGNSSTEPYIVAHNQLLAHAAAVDVYRTKYKDDQKGM
IGPVMITRWFLPFDHSQESKDATERAKIFFHGWFMGPLTEGKYPDIMREY
VGDRLPEFSETEAALVKGSYDFLGLNYYVTQYAQNNQTIVPSDVHTALMD
SRTTLTSKNATGHAPGPPFNAASYYYPKGIYYVMDYFKTTYGDPLIYVTE
NGFSTPGDEDFEKATADYKRIDYLCSHLCFLSKVIKEKNVNVKGYFAWSL
GDNYEFCNGFTVRFGLSYVDFANITGDRDLKASGKWFQKFINV
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 chain7z1i Chain A Residue 608 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7z1i Plant myrosinase TGG1 from Arabidopsis thaliana
Resolution3.09 Å
Binding residue
(original residue number in PDB)
H74 D88
Binding residue
(residue number reindexed from 1)
H54 D68
Annotation score4
Enzymatic activity
Enzyme Commision number 3.2.1.147: thioglucosidase.
3.2.1.21: beta-glucosidase.
Gene Ontology
Molecular Function
GO:0004553 hydrolase activity, hydrolyzing O-glycosyl compounds
Biological Process
GO:0005975 carbohydrate metabolic process

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Molecular Function

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Biological Process
External links
PDB RCSB:7z1i, PDBe:7z1i, PDBj:7z1i
PDBsum7z1i
PubMed
UniProtP37702|BGL38_ARATH Myrosinase 1 (Gene Name=TGG1)

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