Structure of PDB 3db7 Chain A Binding Site BS02
Receptor Information
>3db7 Chain A (length=127) Species:
818
(Bacteroides thetaiotaomicron) [
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GADDDKPIQVTQMPQLAQQFIKQHFSDSKVALAKMESDFLYKSYEVIFTN
GNKVEFDKKGNWEEVDCKHTSVPVAIIPAAIQKYVTTNYPDAKVLKIERD
KKDYEVKLSNRTELKFDLKFNLIDIDN
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
3db7 Chain A Residue 2 [
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Receptor-Ligand Complex Structure
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PDB
3db7
Crystal structure of putative calcium-regulated periplasmic protein of unknown function (NP_809836.1) from BACTEROIDES THETAIOTAOMICRON VPI-5482 at 1.40 A resolution
Resolution
1.4 Å
Binding residue
(original residue number in PDB)
E73 E82
Binding residue
(residue number reindexed from 1)
E55 E64
Annotation score
4
Enzymatic activity
Enzyme Commision number
?
External links
PDB
RCSB:3db7
,
PDBe:3db7
,
PDBj:3db7
PDBsum
3db7
PubMed
UniProt
Q8A994
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