Structure of PDB 5m86 Chain E Binding Site BS01

Receptor Information
>5m86 Chain E (length=321) Species: 273075 (Thermoplasma acidophilum DSM 1728) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
VLQDIDGIFDSQAILAGRFHNDLTVINEKYDLFYLMLPTINEKKIVSFYI
FLQDDQIPERHREEIESVLNKFNPVIKNGIWKIYLDTESFKLSEPFSTFF
GIDSIVFDMGSMKGGEMLLPVRFISKDKDALVNSIIDSAGYGENIYLRYI
GQNKGFDYSFIAIKLLDQVYKLTLSIDNPHVMHGIFAETKKNIAWRRESK
APHKDNTEDYIYALDDTHTIPDILIDTAYTGEKGTVYIGKHSNYDIYRAF
FGDALTNHMSSVMISENVYYLRRWSKYEDGKLFLYFYTTVDFLRLIPAIL
DSTRKNFPKVNMKIDEITPMA
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 chain5m86 Chain E Residue 401 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB5m86 Crystal structure of the Thermoplasma acidophilum protein Ta1207.
Resolution2.4 Å
Binding residue
(original residue number in PDB)		D219 T221
Binding residue
(residue number reindexed from 1)		D215 T217
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:5m86, PDBe:5m86, PDBj:5m86
PDBsum5m86
PubMed28580920
UniProtQ9HIW9

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