| DDB1 co-crystal structures, Protein Data Bank accession codes and ligand SMILES | 9EJQ: CCOc1cccc(C2CC(=O)Nc3c2c(C)nn3-c2ccc3nncn3n2)c1; 37MF: C(c1ccccc1)c1nnc(CN2C=C(C=C(C2=O)[Cl])C(F)(F)F)o1 |
|---|---|
| Structural superposition | The two ligands occupy distinct binding pockets on DDB1 |
Xiaoyun Wang, Shabbir Ahmad, Jianxian Sun, Diwen Yang, Zhipeng Cheng, Xing Qian, Hong Zeng, Aiping Dong, Levon Halabelian, Derek C.G. Muir, Frank Wania, Archer Y. Yang, Hui Peng. “Human exposome toxicity is driven by key toxicants following a Pareto law.” ChemRxiv (). https://doi.org/10.26434/chemrxiv.15007622/v1