ISDA: 9T0H

Deposition Date 2025-10-17

Release Date 2026-03-11

Last Version Date 2026-03-18

Entry Detail

PDB ID:

9T0H

Keywords:

METAL BINDING PROTEIN

Title:

NCS-1 bound to a FDA-approved drug

Biological Source:

Source Organism(s):

Homo sapiens (Taxon ID: 9606)

Expression System(s):

Escherichia coli bl21

Method Details:

Experimental Method:

X-RAY DIFFRACTION

Resolution:

1.91 Å

R-Value Free:

0.25

R-Value Work:

0.21

R-Value Observed:

0.21

Space Group:

C 2 2 21

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Macromolecular Entities

Structures with similar UniProt ID

Protein Blast

Polymer Type:polypeptide(L)
Molecule:Neuronal calcium sensor 1
Gene (Uniprot):NCS1
Chain IDs:A (auth: B)
Chain Length:170
Number of Molecules:1
Biological Source:Homo sapiens

UniProt ID:P62166 Pfam ID:PF00036, PF13499

Ligand Molecules

EOH

H9F

P6G

PEG

Primary Citation

An AI-based approach accelerates the discovery of protein-protein interaction modulators targeting NCS-1.

Gonzalez-Garcia, E, Miro-Rodriguez, C, Ulzurrun, E, Toledano, O, Perez-Suarez, S, Aguado, L, Sanchez-Barrena, M.J, Mansilla, A, Naveiro, R, Campillo, N.E.Show

Eur.J.Med.Chem. 309 118739 118739 (2026)

PMID: 41785832 DOI: 10.1016/j.ejmech.2026.118739

Primary Citation of related structures

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