Structure of PDB 4pls Chain D Binding Site BS04
Receptor Information
>4pls Chain D (length=280) Species:
32630
(synthetic construct) [
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ELPQMVQQLNSPDQQELQSALRKLSQIASGGNEQIQAVIDAGALPALVQL
LSSPNEQILQEALWTLGNIASGGNEQIQAVIDAGALPALVQLLSSPNEQI
LQEALWTLGNIASGGNEQIQAVIDAGALPALVQLLSSPNEQILQEALWTL
GNIASGGNEQIQAVIDAGALPALVQLLSSPNEQILQEALWTLGNIASGGN
EQIQAVIDAGALPALVQLLSSPNEQILQEALWTLGNIASGGNEQKQAVKE
AGAEPALEQLQSSPNEKIQKEAQEALEKIQ
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
4pls Chain B Residue 303 [
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Receptor-Ligand Complex Structure
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PDB
4pls
Crystal Structures of Designed Armadillo Repeat Proteins: Implications of Construct Design and Crystallization Conditions on Overall Structure.
Resolution
2.35 Å
Binding residue
(original residue number in PDB)
P65 E67
Binding residue
(residue number reindexed from 1)
P54 E56
Annotation score
4
External links
PDB
RCSB:4pls
,
PDBe:4pls
,
PDBj:4pls
PDBsum
4pls
PubMed
25132085
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