Structure of PDB 6vu6 Chain E Binding Site BS04
Receptor Information
>6vu6 Chain E (length=409) Species:
888807
(Streptococcus sanguinis SK1 = NCTC 7863) [
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TDTTPPTITLPQEVIAYRGEEFEFFVETTDDSGRVNRVIVRNIEGADNST
YLDPNWIRYSTDNLSVPGNATPANPLRTRVYGIVPINHGVGPGDRYTKYV
RAEDAAGNITALVDKQSERFVLVIRPQTEKYTPQVPTLTYVQNANSLTQT
DKDAVIAAVKSANPNLPATSTYSVSENGTVTITYPDGSTDTIAAAQTVDT
DRVAPVFVDEGRDYIFYRGEEGTAELHFYDNSGKITNVNFAGDLAASSTY
NTLLGLGFTFNTPNINNPNNATEQNPLVTTIRGTIPKSLPAGPGGKYTFK
VRATDASGLTSEAKIFRIVFANQTDKYTPNNPGSLTGVLNPQQLSTSEKT
AIEEKVRAANTGNLPNNVQYVVNNDGSVTVIYPDDTPASRSRDTITADRT
VQDLRPRNS
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
6vu6 Chain E Residue 701 [
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Receptor-Ligand Complex Structure
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PDB
6vu6
Tandem sialoglycan-binding modules in a Streptococcus sanguinis serine-rich repeat adhesin create target dependent avidity effects.
Resolution
2.1 Å
Binding residue
(original residue number in PDB)
D253 T255 D281 D282 D355
Binding residue
(residue number reindexed from 1)
D2 T4 D30 D31 D104
Annotation score
4
External links
PDB
RCSB:6vu6
,
PDBe:6vu6
,
PDBj:6vu6
PDBsum
6vu6
PubMed
32820052
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