Structure of PDB 5ij1 Chain B Binding Site BS01
Receptor Information
>5ij1 Chain B (length=194) Species:
388919
(Streptococcus sanguinis SK36) [
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TDTTPPTITVPSDIIAYRGEEFEFYFEITDDSGQVKNIELSTFGKPLGLN
WLEYSEDNFNVPGNATSDNPLRVRVHGTVPLNEPIPADKNRAQFTRTIRA
WDAAGNVSSNITFVIKYRAQTDKYNPADPTITYVDRLSSLSPSEKNAVEA
AVRAANPQIPAAARITVSANGTVTITYPDSSTDTITANRVVKDL
Ligand information
Ligand ID
CA
InChI
InChI=1S/Ca/q+2
InChIKey
BHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES
Software
SMILES
CACTVS 3.341
[Ca++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0
[Ca+2]
Formula
Ca
Name
CALCIUM ION
ChEMBL
DrugBank
DB14577
ZINC
PDB chain
5ij1 Chain B Residue 501 [
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Receptor-Ligand Complex Structure
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PDB
5ij1
Structures of the Streptococcus sanguinis SrpA Binding Region with Human Sialoglycans Suggest Features of the Physiological Ligand.
Resolution
1.8 Å
Binding residue
(original residue number in PDB)
D253 T255 D281 D282 D353
Binding residue
(residue number reindexed from 1)
D2 T4 D30 D31 D102
Annotation score
4
Enzymatic activity
Enzyme Commision number
?
External links
PDB
RCSB:5ij1
,
PDBe:5ij1
,
PDBj:5ij1
PDBsum
5ij1
PubMed
27685666
UniProt
A3CM52
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