Structure of PDB 5mua Chain A Binding Site BS05

Receptor Information
>5mua Chain A (length=269) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SFQGHGIYYIASAYVANTRLALSESPDVIISSDAVDPLNNLWLIEPVGEA
DTYTVRNAFAGSYMDLAGHAATDGTAIIGYRPTGGDNQKWIISQWKIKSK
ETGTFVTLLNGTVVGWQNITNNTSQNWTFQKLSQTGANVHATLLACPALR
QDFKSYLSDGLYLVLTRDQISSIWQASGLGSTPWRSEIFDCDDFATVFKG
AVAKWGNENFKANGFALLCGLMFGSKSSGAHAYNWFVERGNFSTVTFFEP
QNGTYSANAWDYKAYFGLF
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 chain5mua Chain A Residue 307 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5mua Family of Papain-Like Fungal Chimerolectins with Distinct Ca(2+)-Dependent Activation Mechanism.
Resolution1.49 Å
Binding residue
(original residue number in PDB)		S175 D176
Binding residue
(residue number reindexed from 1)		S158 D159
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0030246 carbohydrate binding
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:5mua, PDBe:5mua, PDBj:5mua
PDBsum5mua
PubMed28665586
UniProtQ75WT9

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