6U32

Crystal structure of HaloTag bound to tetramethylrhodamine-HaloTag ligand

Summary for 6U32

• Entry DOI: 10.2210/pdb6u32/pdb
• Descriptor: HaloTag, 9-[2-carboxy-5-({2-[2-(hexyloxy)ethoxy]ethyl}carbamoyl)phenyl]-6-(dimethylamino)-N,N-dimethyl-3H-xanthen-3-iminium, CHLORIDE ION, ... (4 entities in total)
• Functional Keywords: halotag, haloalkane dehalogenase, tetramethyrhodamine, hydrolase
• Biological source: Rhodococcus sp.
• Total number of polymer chains: 1
• Total formula weight: 34282.63

Authors

Berro, A.J.,Schreiter, E.R. (deposition date: 2019-08-21, release date: 2020-09-30, Last modification date: 2023-10-11)

• Primary citation: Deo, C.,Abdelfattah, A.S.,Bhargava, H.K.,Berro, A.J.,Falco, N.,Farrants, H.,Moeyaert, B.,Chupanova, M.,Lavis, L.D.,Schreiter, E.R.; The HaloTag as a general scaffold for far-red tunable chemigenetic indicators.; Nat.Chem.Biol., 17:718-723, 2021; PubMed: 33795886; DOI: 10.1038/s41589-021-00775-w

Experimental method

X-RAY DIFFRACTION (1.8 Å)