Structure of PDB 5ij1 Chain A Binding Site BS03

Receptor Information
>5ij1 Chain A (length=201) Species: 388919 (Streptococcus sanguinis SK36) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
RRATDTTPPTITVPSDIIAYRGEEFEFYFEITDDSGQVKNIELSTFGKPL
GLNWLEYSEDNFNVPGNATSDNPLRVRVHGTVPLNEPIPADKNRAQFTRT
IRAWDAAGNVSSNITFVIKYRAQTDKYNPADPTITYVDRLSSLSPSEKNA
VEAAVRAANPQIPAAARITVSANGTVTITYPDSSTDTITANRVVKDLASS
R
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 chain5ij1 Chain A Residue 506 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5ij1 Structures of the Streptococcus sanguinis SrpA Binding Region with Human Sialoglycans Suggest Features of the Physiological Ligand.
Resolution1.8 Å
Binding residue
(original residue number in PDB)
T372 Y375 D434
Binding residue
(residue number reindexed from 1)
T124 Y127 D186
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links