Structure of PDB 7tx9 Chain A Binding Site BS01

Receptor Information
>7tx9 Chain A (length=148) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
EKLGDICFSLRYVPTAGKLTVVILEAKNLKKMDVGGLSDPFVKIHLMQNG
KRLKKKKTTIKKNTLNPYYNESFSFEVPFEQIQKVQVVVTVLDYDKIGKN
DAIGKVFVGYNSTGAELRHWSDMLANPRRPIAQWHTLQVEEEVDAMLA
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 chain7tx9 Chain A Residue 501 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7tx9 Human Synaptotagmin-1 C2B Y312F Ca2+ bound
Resolution1.34 Å
Binding residue
(original residue number in PDB)		D304 D310 D364 Y365 D366
Binding residue
(residue number reindexed from 1)		D33 D39 D93 Y94 D95
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology

View graph for
Cellular Component
External links
PDB RCSB:7tx9, PDBe:7tx9, PDBj:7tx9
PDBsum7tx9
PubMed
UniProtJ3KQA0

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