Structure of PDB 6a7s Chain B Binding Site BS01

Receptor Information
>6a7s Chain B (length=138) Species: 311201 (Saxidomus purpurata) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
CCSEDDCPSGWKFFGGSCYLFDEGSRGWEGSKAFCESKDASLVTVECSKE
DDFIRGILSGQTAKHYYWIGARWNEEHNDYRWIDGSPFTFIGWGPGKPDN
NKGCLDYLNYKEVVWQWNDHVDCENTNGPCICEIDCSD
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 chain6a7s Chain B Residue 203 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6a7s Novel Ca2+-independent carbohydrate recognition of the C-type lectins, SPL-1 and SPL-2, from the bivalve Saxidomus purpuratus.
Resolution2.0 Å
Binding residue
(original residue number in PDB)		T44 E46 E50 E133
Binding residue
(residue number reindexed from 1)		T44 E46 E50 E133
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links