Structure of PDB 4wut Chain A Binding Site BS03

Receptor Information
>4wut Chain A (length=290) Species: 311402 (Allorhizobium ampelinum S4) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GEIAVIVKTVNSTFWQNVQKGADAAIGKQKAHTITFQGPAAESAIADQVN
MVENAVNRKVDAILLAPSDPDALVPAVKKAWEARIPVVIIDSMLSKDAEK
YYQAFLATDNKAAGELAAKAMIQKVGTEGKIAVMSYVAGAGSEIGRVGGF
TDYIKANSKLQIVGPYYSQSQMATALNQTTDVLAANADLKGIFGANEPTA
IGMGRAIKQAGKAGKLVAIGFDGNQDLQEFVKDGTLEATVVQGSYQMGEK
GVDTLLKLLSKEKVEKFIDTGVVVVTKQNIDKPEAKNVLY
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 chain4wut Chain A Residue 406 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB4wut CRYSTAL STRUCTURE OF AN ABC TRANSPORTER SOLUTE BINDING PROTEIN (IPR025997) FROM AGROBACTERIUM VITIS (Avi_5133, TARGET EFI-511220) WITH BOUND D-FUCOSE
Resolution1.5 Å
Binding residue
(original residue number in PDB)		K178 S181
Binding residue
(residue number reindexed from 1)		K155 S158
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0030246 carbohydrate binding
GO:0046872 metal ion binding
Cellular Component
GO:0042597 periplasmic space

View graph for
Molecular Function
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Cellular Component
External links
PDB RCSB:4wut, PDBe:4wut, PDBj:4wut
PDBsum4wut
PubMed
UniProtB9K0B2

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