Ki Summary

Reaction Details

Report a problem with these data

Target

Voltage-dependent calcium channel alpha-1 subunit

Ligand

BDBM50488059

Substrate

n/a

Meas. Tech.

ChEMBL_920700 (CHEMBL3066980)

IC50

3.7±n/a nM

Citation

Windley, MJ; Escoubas, P; Valenzuela, SM; Nicholson, GM A novel family of insect-selective peptide neurotoxins targeting insect large-conductance calcium-activated K+ channels isolated from the venom of the theraphosid spider Eucratoscelus constrictus. Mol Pharmacol 80:1-13 (2011) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Target

Name:

Voltage-dependent calcium channel alpha-1 subunit

Synonyms:

Voltage-dependent calcium channel alpha-1 subunit

Type:

PROTEIN

Mol. Mass.:

99875.60

Organism:

German cockroach

Description:

ChEMBL_106597

Residue:

871

Sequence:

LFGGKFDFNNTVDKPRSNFDSFWQSLLTVFQILTGEDWNAVMYVGIQAYGGVSSIGVLACVYFIILFICGNYILLNVFLAIAVDNLADAESLTAIEKEAEEEAEKQQKSHSGSPAREEGQPEEGEGGEEPEKGLVNETENLEKEETESETKVPLEHGDSEDYQYHYEEHTDNQEEEEDEDHREPKSTARPRNVGDQPENNDSSTPEGSAFFIFSNTNRIRVFCHWLCNHSYFGNMILACIMISSAMLAAEEPLRAETPRNEILGKFDIFFTSVFTIEICLKMISYGFVLHDGAFCRSAFNLLDMLVVFVSLIAMFIRGSAISVIKILRVMRVLRPLRTINRAKGLKHVVQCVIVAVKTIGNIVLVTCLVQFMFAVIGVQLFKGKFFRCSDGSKMTEAECHGTYLVFDDGDINQPEVEERRWTRNRFHFDDVAKAMLTLFTVSTFEGWPGLLYVSIDSHDEDEGPIHNFRPIVAIFFIVYIIIIAFFMVNIFVGFVIVTFQNEGEQEYKNCELDKNQRNCIEFALKAKPVRRYIPKHRIQYKVWWFVTSQPFEYTIFILIMLNTITLAMKFYNQPKYYEDFLDVLNIIFTAVFAMEFVFKLAAFRFKNYFGNAWNVFDFIIVLGSFIDIIYSEVNTPTRLKPGSGMISINFFRLFRVMRLVKLLSRGEGIRTLLWTFIKSFQALPYVALLIVMLFFIYAVIGMQMFGKIALDSGTAIHRNNNFQTFPQAVLLLFRSATGEAWQDIMLDGSARDGVRCDSESDEKDKPICGSDMAFPYFISFYVLCSFLIINLFVAVIMDNFDYLTRDWSILGPHHLDEFIRLWSEYDPDAKGRIKHLDVVTLLRKISPPLGFGKLCPHRVACKRLVSMNMPL

Inhibitor

Name:

BDBM50488059

Synonyms:

CHEMBL2272094

Type:

Small organic molecule

Emp. Form.:

C157H235N39O46S7

Mol. Mass.:

3629.3

SMILES:

CSCC[C@@H]1NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H]2CSSC[C@H](NC(=O)[C@@H](N)Cc3ccc(O)cc3)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc3ccccc3)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H]3CSSC[C@H](NC(=O)[C@@H](NC1=O)C(C)C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c4ccccc14)C(=O)N[C@@H](CSSC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC3=O)[C@@H](C)O)C(=O)N2)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCCCN)C(O)=O |r|

Structure: