9X7F

Crystal structure of PDCoV 3CL protease (3CLpro) in complex with compound 1

This is a non-PDB format compatible entry.

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B, C, D, E... (A, B, C, D, E...)	3C-like protease	polymer	301	33972.6	6	UniProt (A0A166XB12) Pfam (PF05409)	Porcine deltacoronavirus
2	G, H, I, J, K... (A, B, C, D, E...)	(2~{S})-~{N}-[(2~{S})-1-azanylidene-3-[(3~{S})-2-oxidanylidenepyrrolidin-3-yl]propan-2-yl]-2-[[(2~{S})-3,3-dimethyl-2-[2,2,2-tris(fluoranyl)ethanoylamino]butanoyl]amino]-4-methyl-pentanamide	non-polymer		477.5	6	Chemie (A1D7G)
3	M, N, O, P, Q... (A, B, C, D, E...)	water	water		18.0	76	Chemie (HOH)

Contents of the asymmetric unit

Polymers	Number of chains	6
	Total formula weight	203835.8
Non-Polymers*	Number of molecules	6
	Total formula weight	2865.1
All*	Total formula weight	206701.0

*Water molecules are not included.