Target Binding Site Detail

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Target General Information
Ligand General Information
Drug Binding Sites of Target
References
Target General Information  Top
Target ID T51115 Target Info
Target Name Voltage-gated calcium channel alpha Cav1.2 (CACNA1C)
Synonyms Voltage-gated calcium channel subunit alpha Cav1.2; Voltage-dependent L-type calcium channel subunit alpha-1C; Calcium channel, L type, alpha-1 polypeptide, isoform 1, cardiac muscle; CCHL1A1; CACNL1A1; CACN2; CACH2
Target Type Successful Target
Gene Name CACNA1C
Biochemical Class Voltage-gated ion channel
UniProt ID
CAC1C_HUMAN
Ligand General Information  Top
Ligand Name 1,3-Bis(bromomethyl)benzene Ligand Info
Canonical SMILES C1=CC(=CC(=C1)CBr)CBr
InChI 1S/C8H8Br2/c9-5-7-2-1-3-8(4-7)6-10/h1-4H,5-6H2
InChIKey OXHOPZLBSSTTBU-UHFFFAOYSA-N
PubChem Compound ID 69373
Drug Binding Sites of Target  Top
PDB ID: 5V2Q      CaV beta2a subunit: CaV1.2 AID-CEN complex
Method X-ray diffraction Resolution 1.70 Å Mutation Yes [1]
PDB Sequence
ASPLEEDLCG
436
YLCWITQAE
Residue
Distance (Å)
CYS435
1.972
LEU438
4.826
Residue
Distance (Å)
CYS439
1.995
THR442
3.818
PDB ID: 5V2P      CaV beta2a subunit: CaV1.2 AID-CAP complex
Method X-ray diffraction Resolution 2.00 Å Mutation Yes [1]
PDB Sequence
CSPLECDLKG
436
YLDWITQAE
Residue
Distance (Å)
CYS427
1.815
Residue
Distance (Å)
CYS432
1.816
References  Top
REF 1 Stapled Voltage-Gated Calcium Channel (Ca(V)) Alpha-Interaction Domain (AID) Peptides Act As Selective Protein-Protein Interaction Inhibitors of Ca(V) Function. ACS Chem Neurosci. 2017 Jun 21;8(6):1313-1326.

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