ISDA: 9SWH

Deposition Date 2025-10-06

Release Date 2026-08-26

Last Version Date 2026-08-26

Entry Detail

PDB ID:

9SWH

Keywords:

OXIDOREDUCTASE

Title:

Crystal structure of aldo-keto reductase 1C3 (AKR1C3) in complex with NADP+ and Myxoglucamide A

Biological Source:

Source Organism(s):

Homo sapiens (Taxon ID: 9606)

Expression System(s):

Escherichia coli bl21(de3)

Method Details:

Experimental Method:

X-RAY DIFFRACTION

Resolution:

1.99 Å

R-Value Free:

0.28

R-Value Work:

0.23

R-Value Observed:

0.23

Space Group:

P 1

Download Validation Report

Macromolecular Entities

Polymer Type:polypeptide(L)
Molecule:Aldo-keto reductase family 1
Chain IDs:A, B
Chain Length:344
Number of Molecules:2
Biological Source:Homo sapiens

Ligand Molecules

A1JRA

BU3

NAP

Primary Citation

Synthesis and Activity-Based Protein Profiling Identifies Aldo-Keto Reductase 1C3 as Target Protein of Myxoglucamides.

Siemon, T, Mishra, V.K, Zhao, M, Bussow, K, Popoff, A, Fu, C, Muller, R, Jansch, L, Blankenfeldt, W, Bronstrup, M.Show

Angew.Chem.Int.Ed.Engl. ? e6489568 e6489568 (2026)

PMID: 42573019 DOI: 10.1002/anie.6489568

Primary Citation of related structures

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