Structure of PDB 6efb Chain A Binding Site BS01

Receptor Information
>6efb Chain A (length=201) Species: 1302 (Streptococcus gordonii) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
DTERPVVDFPGEINVYRGESFEFIATATDNSNAFDINKTYVRWYNGTDSG
RGTEWIEKTVTQEGNLLKVKVHGKVPVDTDIGHYTRYVMVTDAAGNQNVS
NEEFSARILNGQFRIVIRYRPNLPENTVLVNNPSQLSETEKNQVREAIKQ
SNPNLRPIDVAGKNLDTAISVSNNGTTTITFRDNRKATIQGKDLVDTRAG
S
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 chain6efb Chain A Residue 502 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6efb Origins of glycan selectivity in streptococcal Siglec-like adhesins suggest mechanisms of receptor adaptation.
Resolution1.9 Å
Binding residue
(original residue number in PDB)		D257 E259 D285 N286 D348
Binding residue
(residue number reindexed from 1)		D1 E3 D29 N30 D92
Annotation score4
External links