Structure of PDB 5c9l Chain A Binding Site BS01

Receptor Information
>5c9l Chain A (length=353) Species: 29488 (Photorhabdus luminescens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
IENSAIALSGIVSVANNADNRLEVFGVSTDSAVWHNWQTAPLPNSSWAGW
NKFNGVVTSKPAVHRNSDGRLEVFVRGTDNALWHNWQTAADTNTWSSWQP
LYGGITSNPEVCLNSDGRLEVFVRGSDNALWHIWQTAAHTNSWSNWKSLG
GTLTSNPAAHLNADGRIEVFARGADNALWHIWQTAAHTDQWSNWQSLKSV
ITSDPVVINNCDGRLEVFARGADSTLRHISQIGSDSVSWSNWQCLDGVIT
SAPAAVKNISGQLEVFARGADNTLWRTWQTSHNGPWSNWSSFTGIIASAP
TVAKNSDGRIEVFVLGLDKALWHLWQTTSSTTSSWTTWALIGGITLIDAS
VIK
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 chain5c9l Chain A Residue 403 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5c9l A Novel Fucose-binding Lectin from Photorhabdus luminescens (PLL) with an Unusual Heptabladed beta-Propeller Tetrameric Structure.
Resolution1.65 Å
Binding residue
(original residue number in PDB)		D132 H203
Binding residue
(residue number reindexed from 1)		D116 H187
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:5c9l, PDBe:5c9l, PDBj:5c9l
PDBsum5c9l
PubMed27758853
UniProtQ7N8J0

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