ISDA: 9I85

Deposition Date 2025-02-04

Release Date 2026-08-19

Last Version Date 2026-08-19

Entry Detail

PDB ID:

9I85

Keywords:

APOPTOSIS

Title:

Structure of Mcl-1 complex with small molecule inhibitor

Biological Source:

Source Organism(s):

Homo sapiens (Taxon ID: 9606)

Expression System(s):

Escherichia coli bl21

Method Details:

Experimental Method:

X-RAY DIFFRACTION

Resolution:

1.90 Å

R-Value Free:

0.23

R-Value Work:

0.19

Space Group:

P 65 2 2

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Macromolecular Entities

Polymer Type:polypeptide(L)
Molecule:Induced myeloid leukemia cell
Chain IDs:A
Chain Length:170
Number of Molecules:1
Biological Source:Homo sapiens

Ligand Molecules

12P

A1I07

Primary Citation

Absolute residence times estimation from scaled molecular dynamics simulations: application to Mcl-1 inhibitors

Martiny, V, Theret, I, Dererchi, S.Show

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