Structure of PDB 8boz Chain O Binding Site BS01

Receptor Information
>8boz Chain O (length=521) Species: 562 (Escherichia coli) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PGLIIFVHGVNSEGEWYDYAERSLCAGLNQRLGLEGEHGLKENNYEGGFF
VKKWVSGPRKITKGGDGRSPVIRFYWGYRAADNETDTYAIPLKNKKGDNY
YDLPPESRKAKGPWFWGGGPFQNGCNQLVSLWSKTGFNNVPLPFSTQVLN
DRLLSDAPPRHYYAHAAGRLAKLIKTIRNQHPEDTVTVLSHSQGTMIALA
AAAIEAPDALFVMNSPYALENEPTTYISYPIKEIISRKARSATFADIVKK
VAENKTWIPEGKTHNGLPERDNHGTTWIYCNPHDRVMGSSPLRSIGWQGL
PDTKDGTPHTLFKQAGDTLYVRILGRNTPCGGTPTAQTHFSNLGDGKPFW
DSTTTLLQRATWPDPDSGQTLTINAPQVPEPLTAEELKNFDQDYARDEKQ
SGGAGYAYGQINPETKKPVDTDYRYYISEEMLEEVRTYVQRPTDHSTLPS
DERFMSRVVAYDLPIGSWDKAGLEELRRQADWLESDDYYFSGKLTVPPIP
PAIKQDVAEDAEQRKAEEKAR
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 chain8boz Chain O Residue 701 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
PDB8boz Activity and Crystal Structure of the Adherent-Invasive Escherichia coli Tle3/Tli3 T6SS Effector/Immunity Complex Determined Using an AlphaFold2 Predicted Model.
Resolution3.6 Å
Binding residue
(original residue number in PDB)		R378 D444 D484 D573
Binding residue
(residue number reindexed from 1)		R285 D351 D391 D444
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:8boz, PDBe:8boz, PDBj:8boz
PDBsum8boz
PubMed36675258
UniProtA0A0H2VAD3

[Back to BioLiP]