Structure of PDB 6m8m Chain A Binding Site BS03

Receptor Information
>6m8m Chain A (length=177) Species: 1163748 (Marinobacter nauticus ATCC 49840) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AVQGLFGEYYAYAQGSDGGNLSNVAQVKAFIAANEADATFIGRNIDYGSV
SGDLGGNGKVQSFLKDDAGSLSTDPENSSDAIVKLTGNLELQAGTYQFRV
RADDGYRIEVNGQTVAEYNGNQGANTRTGSEFTLTGDGPHSVEIVYWDQG
GAAQLRIELREQGGAYEIFGSQHASHG
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 chain6m8m Chain A Residue 303 [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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PDB6m8m Structure and functional analysis of a bacterial adhesin sugar-binding domain.
Resolution1.2 Å
Binding residue
(original residue number in PDB)		Q47 N53 D113 Q182
Binding residue
(residue number reindexed from 1)		Q14 N20 D80 Q149
Annotation score4
External links