Structure of PDB 2bwr Chain B Binding Site BS01

Receptor Information
>2bwr Chain B (length=401) Species: 71681 (Lacrymaria velutina) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SVVVISQALPVPTRIPGVADLVGFGNGGVYIIRNSLLIQVVKVINNFGYD
AGGWRVEKHVRLLADTTGDNQSDVVGFGENGVWISTNNGNNTFVDPPKMV
LANFAYAAGGWRVEKHIRFMADLRKTGRADIVGFGDGGIYISRNNGGGQF
APAQLALNNFGYAQGWRLDRHLRFLADVTGDGLLDVVGFGENQVYIARNS
GNGTFQPAQAVVNNFCIGAGGWTISAHPRVVADLTGDRKADILGFGVAGV
YTSLNNGNGTFGAVNLVLKDFGVNSGWRVEKHVRCVSSLTNKKVGDIIGF
GDAGVYVALNNGNGTFGPVKRVIDNFGYNQGWRVDKHPRFVVDLTGDGCA
DIVGFGENSVWACMNKGDGTFGPIMKLIDDMTVSKGWTLQKTVRYAANLY
L
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 chain2bwr Chain B Residue 500 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB2bwr Beta-Propeller Crystal Structure of Psathyrella Velutina Lectin: An Integrin-Like Fungal Protein Interacting with Monosaccharides and Calcium.
Resolution1.5 Å
Binding residue
(original residue number in PDB)		D343 T345 D347 C349 D351
Binding residue
(residue number reindexed from 1)		D343 T345 D347 C349 D351
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:2bwr, PDBe:2bwr, PDBj:2bwr
PDBsum2bwr
PubMed16497330
UniProtQ309D1

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