Structure of PDB 5cwf Chain A Binding Site BS04
Receptor Information
>5cwf Chain A (length=177) Species:
32630
(synthetic construct) [
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MSDEMKKVMEALKKAVELAKKNNDDEVAREIERAAKEIVEALRENNSDEM
AKVMLALAKAVLLAAKNNDDEVAREIARAAAEIVEALRENNSDEMAKVML
ALAKAVLLAAKNNDDEVAREIARAAAEIVEALRENNSDEMAKKMLELAKR
VLDAAKNNDDETAREIARQAAEEVEAD
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
5cwf Chain A Residue 208 [
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Receptor-Ligand Complex Structure
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PDB
5cwf
Exploring the repeat protein universe through computational protein design.
Resolution
1.8 Å
Binding residue
(original residue number in PDB)
N67 N113
Binding residue
(residue number reindexed from 1)
N67 N113
Annotation score
4
External links
PDB
RCSB:5cwf
,
PDBe:5cwf
,
PDBj:5cwf
PDBsum
5cwf
PubMed
26675729
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