ISDA: 9SI2

Deposition Date 2025-08-28

Release Date 2026-07-29

Last Version Date 2026-07-29

Entry Detail

PDB ID:

9SI2

Keywords:

TRANSFERASE

Title:

Human DDR1 in complex with a pyrrolidine inhibitor

Biological Source:

Source Organism(s):

Homo sapiens (Taxon ID: 9606)

Expression System(s):

Spodoptera frugiperda

Method Details:

Experimental Method:

X-RAY DIFFRACTION

Resolution:

2.12 Å

R-Value Free:

0.25

R-Value Work:

0.21

R-Value Observed:

0.21

Space Group:

P 21 21 21

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Macromolecular Entities

Structures with similar UniProt ID

Structural Superimposition Protein Blast

Polymer Type:polypeptide(L)
Molecule:Epithelial discoidin domain-c
Gene (Uniprot):DDR1
Chain IDs:A
Chain Length:310
Number of Molecules:1
Biological Source:Homo sapiens

UniProt ID:Q08345 Pfam ID:PF07714 EC:2.7.10.1

Ligand Molecules

A1JN1

B3P

Primary Citation

A Journey through Scaffolds: Indolines, Pyrrolidines, and Azetidines in the Quest for Inhaled DDR Inhibitors for IPF.

Carzaniga, L, Rancati, F, Rizzi, A, Mazzucato, R, Iotti, N, Ghidini, E, Bertolini, S, Bignami, F, Fioni, A, Mileo, V, Vaccaro, F, Murgo, A, Freire Bento, A, Capelli, A.M, Whittaker, B.P, Levanto, S, Chapman, R.S.L, Hamasova, Z, Hardy, C.J, Clark, D.E, Allen, R, Briggs, M.A, Hann, E, Lee, S, Matthews, C, Todd, D, Hawkins, J, Giuliani, M.Show

J.Med.Chem. 69 6610 6633 (2026)

PMID: 41715301 DOI: 10.1021/acs.jmedchem.5c02830

Primary Citation of related structures

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