Structure of PDB 4rus Chain B Binding Site BS01

Receptor Information
>4rus Chain B (length=235) Species: 7962 (Cyprinus carpio) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
LDCTVIDGNLKQIDAGSGSVVGVNNLNETFVLIDNVFTKISGSLKHFSVG
PAGQLGVNTANNIFKYQSGGFVQLAGLLKQVDAGGDQIIAGVNMYDDIYC
LNMDANNKWPSSNTPWVQLNGKLKYYSCGPYSCWGVNSNDQIFIMKDVSS
NVCSGSGSFINIPGLLSMIEVATDGSVFGVNSQGNLYQRTGVTRSKPDGT
DWISMVACPNGHKHVSFDLGVLWLVCVDGSIRKCI
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 chain4rus Chain B Residue 303 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB4rus Three-dimensional structure and ligand-binding site of carp fishelectin (FEL).
Resolution1.7 Å
Binding residue
(original residue number in PDB)
D14 D82 E170
Binding residue
(residue number reindexed from 1)
D14 D82 E170
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0030246 carbohydrate binding
Cellular Component
GO:0005576 extracellular region

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Molecular Function

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Cellular Component
External links
PDB RCSB:4rus, PDBe:4rus, PDBj:4rus
PDBsum4rus
PubMed25945578
UniProtP68512|FEL_CYPCA Fish-egg lectin

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