ISDA: 9TLW

Deposition Date 2025-12-11

Release Date 2026-08-19

Last Version Date 2026-08-19

Entry Detail

PDB ID:

9TLW

Keywords:

DE NOVO PROTEIN

Title:

De novo designed single-chain antiparallel coiled-coil hairpin with binding site for MCL-1, Sc-apCC-2-MCL-1-4 in complex with MCL-1

Biological Source:

Source Organism(s):

synthetic construct (Taxon ID: 32630)
Homo sapiens (Taxon ID: 9606)

Expression System(s):

Escherichia coli 'bl21-gold(de3)plyss ag'

Method Details:

Experimental Method:

X-RAY DIFFRACTION

Resolution:

2.80 Å

R-Value Free:

0.29

R-Value Work:

0.24

R-Value Observed:

0.25

Space Group:

P 1 21 1

Download Validation Report

Macromolecular Entities

Polymer Type:polypeptide(L)
Molecule:Sc-apCC-2-MCL-1-4
Chain IDs:A, C
Chain Length:75
Number of Molecules:2
Biological Source:synthetic construct

Polymer Type:polypeptide(L)
Molecule:Induced myeloid leukemia cell
Chain IDs:B, D
Chain Length:156
Number of Molecules:2
Biological Source:Homo sapiens

Primary Citation

De Novo-Designed Bifunctional

Mylemans, B, Korona, B, Acevedo-Jake, A.M, MacRae, A, Edwards, T.A, Huang, D.T, Wilson, A.J, Itzhaki, L.S, Woolfson, D.N.Show

J.Am.Chem.Soc. ? ? ? (2026)

DOI: 10.1021/jacs.6c07593

Primary Citation of related structures

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