8TDP

Time-resolved SFX-XFEL crystal structure of CYP121 bound with cYY reacted with peracetic acid for 200 milliseconds

Replaces:  7RUK

Summary for 8TDP

• Entry DOI: 10.2210/pdb8tdp/pdb
• Related: 7S0O
• Descriptor: Mycocyclosin synthase, SULFATE ION, PROTOPORPHYRIN IX CONTAINING FE, ... (6 entities in total)
• Functional Keywords: sfx, room temperature, es complex, p450, oxidoreductase
• Biological source: Mycobacterium tuberculosis H37Rv
• Total number of polymer chains: 1
• Total formula weight: 44631.83

Authors

Nguyen, R.C.,Dasgupta, M.,Bhowmick, A.,Kern, J.F.,Liu, A. (deposition date: 2023-07-04, release date: 2023-11-22, Last modification date: 2023-12-06)

• Primary citation: Nguyen, R.C.,Davis, I.,Dasgupta, M.,Wang, Y.,Simon, P.S.,Butryn, A.,Makita, H.,Bogacz, I.,Dornevil, K.,Aller, P.,Bhowmick, A.,Chatterjee, R.,Kim, I.S.,Zhou, T.,Mendez, D.,Paley, D.W.,Fuller, F.,Alonso Mori, R.,Batyuk, A.,Sauter, N.K.,Brewster, A.S.,Orville, A.M.,Yachandra, V.K.,Yano, J.,Kern, J.F.,Liu, A.; In Situ Structural Observation of a Substrate- and Peroxide-Bound High-Spin Ferric-Hydroperoxo Intermediate in the P450 Enzyme CYP121.; J.Am.Chem.Soc., 145:25120-25133, 2023; PubMed: 37939223; DOI: 10.1021/jacs.3c04991

Experimental method

X-RAY DIFFRACTION (1.85 Å)